data_4ba8_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 4ba8 _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 . . . . . . . . . . . . . 34.2 t70 . . . . . 0 CA--C 1.513 -0.456 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.523 HG21 HD21 ' A' ' 31' ' ' LEU . 67.7 mt -75.67 122.2 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.119 0.485 . . . . 0.0 111.883 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.441 HD21 ' HE1' ' A' ' 7' ' ' PHE . 11.1 mp -103.97 131.57 51.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.276 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.445 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 6.7 t -124.42 127.64 47.84 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.521 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.635 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 93.5 m-85 -138.0 148.7 45.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.52 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.7 p -112.35 141.57 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.738 0.304 . . . . 0.0 110.714 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.3 mm -117.15 122.74 30.82 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 121.114 0.483 . . . . 0.0 110.361 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.25 143.59 17.69 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.013 2.475 . . . . 0.0 111.754 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.68 141.84 38.58 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 121.988 1.792 . . . . 0.0 110.328 175.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.414 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.9 m -80.05 156.22 27.2 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.36 -174.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.669 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 84.4 t80 -53.99 -42.91 69.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.779 0.323 . . . . 0.0 110.266 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -61.68 -45.7 92.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.191 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -62.28 -44.47 96.45 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.972 0.415 . . . . 0.0 110.776 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 12' ' ' SER . 54.8 mt -65.52 -29.44 47.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.54 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.667 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 29.3 t80 -71.49 -39.71 70.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.315 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 20.7 mt -67.0 -48.41 68.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.093 -176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -89.52 -23.11 22.12 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.163 -175.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 64.04 19.22 11.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.963 -175.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.4 m -137.74 134.24 35.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.895 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.38 141.36 30.05 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 10.0 p30 -127.27 137.41 52.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.149 0.499 . . . . 0.0 109.899 -176.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 84.6 mt -95.86 126.52 41.18 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.687 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 m -120.05 132.47 55.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.835 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 39.7 t -123.1 137.39 54.93 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.73 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -117.55 123.19 45.64 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.469 HG12 HG12 ' A' ' 87' ' ' VAL . 22.7 t -122.56 119.63 58.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.036 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.2 t -137.15 178.75 6.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.611 -172.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 61.08 30.19 19.33 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.691 0.619 . . . . 0.0 111.742 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.523 HD21 HG21 ' A' ' 4' ' ' ILE . 44.3 mt -62.15 126.31 26.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.336 0.589 . . . . 0.0 110.154 -179.772 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.477 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.8 mm -120.95 137.13 55.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 25.4 m -130.12 130.03 44.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.764 0.316 . . . . 0.0 111.226 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 70.9 m95 -117.31 141.91 47.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.523 175.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.38 156.3 40.43 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.631 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.445 ' HA ' ' HD2' ' A' ' 83' ' ' PHE . 19.6 m -74.98 158.84 32.59 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -54.08 -30.85 49.9 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.047 0.451 . . . . 0.0 111.277 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -73.4 -1.56 18.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.96 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.84 21.37 47.02 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.073 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -99.95 122.04 52.07 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -58.67 137.9 82.72 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.859 2.373 . . . . 0.0 112.385 -176.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 49' ' ' LEU . 10.9 mt -103.51 146.55 28.36 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.99 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.79 105.87 0.5 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.227 175.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.658 -176.594 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 121.179 0.514 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.52 151.65 27.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.476 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.4 mtmt -131.63 140.49 49.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.078 0.466 . . . . 0.0 110.153 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.477 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -117.19 125.92 6.73 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 174.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 54.2 t -108.63 120.84 60.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.818 0.342 . . . . 0.0 110.426 -178.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.431 ' HB1' ' HB2' ' A' ' 24' ' ' LEU . . . -114.46 140.17 48.93 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.895 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.3 m -99.39 115.03 28.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.152 0.501 . . . . 0.0 110.445 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -119.69 166.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.053 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.412 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 21.6 m -82.11 137.26 35.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.96 -28.54 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.917 177.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -56.99 -42.2 79.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.621 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.412 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 46.1 m-20 -63.08 -47.85 81.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 109.904 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -63.56 -39.0 93.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.328 177.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -69.45 -28.65 66.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.76 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -94.48 12.64 26.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 64.7 36.87 7.92 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.283 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.81 163.74 26.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.038 0.447 . . . . 0.0 110.539 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -130.71 139.34 50.29 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.595 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.654 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 83.9 m-85 -121.52 162.04 21.24 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.215 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 75.0 t -122.94 126.54 73.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.99 0.424 . . . . 0.0 111.073 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 48.5 t -106.4 136.89 45.36 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 173.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.453 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -124.36 129.57 50.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.767 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.469 HG12 HG12 ' A' ' 28' ' ' VAL . 38.9 t -102.27 126.63 56.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.668 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.1 p -117.43 93.58 4.22 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.473 0.654 . . . . 0.0 110.673 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.514 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 74.8 t60 -99.46 -7.13 26.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.181 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 89' ' ' HIS . 37.6 ptt85 65.08 -11.79 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.476 1.51 . . . . 0.0 112.537 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.514 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 16.0 t70 -76.27 -33.95 59.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.467 0.651 . . . . 0.0 110.304 -174.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.89 153.68 37.73 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.564 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.23 -23.63 11.67 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.083 2.522 . . . . 0.0 112.55 -178.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.9 m -132.02 114.78 15.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.917 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.453 ' HB2' HG23 ' A' ' 86' ' ' THR . 14.3 Cg_endo -56.84 141.15 92.88 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.933 2.422 . . . . 0.0 111.913 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -89.65 127.1 35.87 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.458 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.9 ptpt -108.22 140.76 40.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.359 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 6' ' ' THR . 62.3 mmtt -127.37 139.97 52.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.978 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -101.67 136.99 40.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.709 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 tt -131.38 138.87 52.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.866 0.365 . . . . 0.0 110.956 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.6 t -154.53 149.99 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.581 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.408 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 53.4 tttm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.452 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 . . . . . 0 CA--C 1.519 -0.239 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.529 HG12 ' HA ' ' A' ' 31' ' ' LEU . 54.4 mt -60.28 126.93 18.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.36 130.92 52.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.164 0.507 . . . . 0.0 110.673 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -112.56 119.46 38.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.066 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.669 ' HD1' ' CD2' ' A' ' 7' ' ' PHE . 58.1 m-85 -119.77 135.37 54.87 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.722 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.4 p -113.67 132.43 55.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.818 0.342 . . . . 0.0 110.533 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.64 124.79 28.58 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.189 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.31 140.44 58.5 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.775 2.317 . . . . 0.0 111.518 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.411 ' HB2' HD12 ' A' ' 16' ' ' ILE . 18.2 Cg_endo -59.05 162.03 14.59 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.271 2.647 . . . . 0.0 113.071 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.508 ' O ' HG13 ' A' ' 16' ' ' ILE . 40.7 t -78.73 114.24 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.351 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.529 ' HA ' HD13 ' A' ' 16' ' ' ILE . 32.7 t80 -56.7 -35.32 68.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.568 -171.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -44.76 70.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.992 0.425 . . . . 0.0 111.049 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.56 -33.67 76.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.03 -176.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.8 mt -57.85 -40.19 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.909 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -72.36 -39.33 68.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.465 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.14 -48.01 59.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.448 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.7 m -78.26 -12.82 60.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.969 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp 66.24 7.88 5.18 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.046 -176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.9 m -138.41 134.69 34.43 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.993 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.663 ' HB1' HG13 ' A' ' 72' ' ' VAL . . . -80.57 165.4 22.13 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.688 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 25.2 m120 -139.76 151.79 46.08 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.721 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 80.9 mt -114.01 119.69 38.05 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.211 -177.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.7 m -105.02 123.42 47.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.311 0.577 . . . . 0.0 111.312 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.2 t -109.83 137.06 48.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.267 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.547 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 1.3 tm? -127.5 122.55 33.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.14 120.95 54.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.744 0.306 . . . . 0.0 110.561 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 t -137.93 178.09 7.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.448 -175.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 59.14 42.01 19.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.564 0.54 . . . . 0.0 112.182 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HA ' HG12 ' A' ' 4' ' ' ILE . 16.3 mt -71.9 124.06 24.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 175.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB1' ' OD2' ' A' ' 91' ' ' ASP . . . . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.41 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.516 HG22 ' HA3' ' A' ' 68' ' ' GLY . 30.4 mm -119.79 137.31 54.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 176.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 86' ' ' THR . 22.6 t -143.28 138.75 29.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.045 -0.662 . . . . 0.0 111.457 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.503 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 86.3 m95 -126.22 143.23 51.22 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.605 177.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.39 160.4 43.46 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.462 ' HB2' ' OE1' ' A' ' 47' ' ' GLU . 18.7 m -87.59 160.13 18.3 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -54.36 -37.32 64.81 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.417 ' HB3' ' OE1' ' A' ' 47' ' ' GLU . 10.6 t -85.59 6.61 26.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.016 0.436 . . . . 0.0 110.995 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.93 23.59 24.96 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.547 173.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.462 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 3.2 mp0 -84.51 122.12 75.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.6 136.73 64.69 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.419 2.079 . . . . 0.0 111.72 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -113.68 139.78 48.78 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.645 -176.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.55 106.66 2.23 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.895 177.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 8.9 m . . . . . 0 C--N 1.317 -0.815 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.931 -176.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 p . . . . . 0 C--O 1.24 0.553 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.74 145.27 32.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.184 167.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -131.21 138.25 49.29 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.98 0.419 . . . . 0.0 110.072 -176.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.516 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -146.89 136.72 6.3 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 176.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.721 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 5.6 m -116.95 149.94 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 117.319 0.559 . . . . 0.0 111.342 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 51' ' ' THR . . . -114.59 150.39 35.09 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.427 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -98.33 114.73 27.15 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 122.105 0.955 . . . . 0.0 110.063 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.663 HG13 ' HB1' ' A' ' 22' ' ' ALA . 2.1 t -119.41 153.36 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.628 0 CA-C-N 113.401 -1.727 . . . . 0.0 109.383 -173.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -83.98 141.1 31.46 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.473 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.5 p -53.16 -33.13 19.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-O 121.057 0.456 . . . . 0.0 109.901 176.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -55.62 -36.64 67.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.423 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -68.15 -51.91 40.62 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.122 0.487 . . . . 0.0 109.974 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -66.73 -34.96 79.0 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.515 -177.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 32.3 t30 -71.73 -22.16 61.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.71 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -101.33 8.88 42.14 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.829 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 64.99 37.91 6.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.25 151.1 13.21 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.48 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -109.06 138.11 45.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.448 172.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.642 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 74.1 m-85 -127.6 156.05 42.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.162 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.5 t -119.17 127.37 75.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.608 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 49.9 t -105.47 130.94 53.44 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.519 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -125.54 122.41 36.45 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.552 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.0 t -108.55 127.37 65.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.769 0.319 . . . . 0.0 111.004 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.451 HG23 ' HB3' ' A' ' 95' ' ' PRO . 23.3 p -122.16 108.82 13.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.102 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.48 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 84.9 t60 -98.43 -50.99 4.11 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.977 -176.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 37.6 ttt-85 128.55 -20.5 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 O-C-N 125.178 1.549 . . . . 0.0 107.735 -163.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.48 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.32 -37.32 66.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.314 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.15 152.14 75.45 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.281 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.32 -23.33 13.38 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.433 2.755 . . . . 0.0 112.86 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.7 m -125.59 109.93 25.78 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.481 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.519 ' HB2' HG23 ' A' ' 86' ' ' THR . 14.1 Cg_endo -56.8 142.11 92.31 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 123.026 2.484 . . . . 0.0 112.528 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 86' ' ' THR . 41.3 mt-30 -80.94 131.37 35.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.161 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -109.46 127.89 54.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.303 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 57.6 mmtt -122.64 133.74 54.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -178.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.0 m-85 -100.91 132.71 46.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.7 tt -126.63 139.02 52.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.099 0.476 . . . . 0.0 111.255 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.1 p -158.02 149.45 21.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.613 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.874 178.672 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 30' ' ' ASN . 33.1 t70 . . . . . 0 CA--C 1.516 -0.348 0 CA-C-O 120.748 0.309 . . . . 0.0 110.426 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.13 124.38 17.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.933 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.76 130.81 49.85 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.222 0.534 . . . . 0.0 109.877 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.458 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.7 m -114.66 118.29 33.25 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.005 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.69 142.68 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.176 0.513 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -119.29 131.61 55.78 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.122 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 37.1 mm -117.88 124.97 28.34 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.302 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.35 143.64 83.47 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 122.738 2.292 . . . . 0.0 111.798 175.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.579 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 44.8 Cg_endo -65.77 152.12 82.49 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.674 2.249 . . . . 0.0 111.825 178.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.477 ' O ' HG13 ' A' ' 16' ' ' ILE . 34.3 t -78.23 124.29 27.91 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.645 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.629 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 89.9 m-85 -61.36 -29.55 69.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.409 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.39 77.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.216 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.9 -45.83 76.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.19 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.534 HG12 ' HA ' ' A' ' 22' ' ' ALA . 73.2 mt -56.99 -33.09 41.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 121.147 0.499 . . . . 0.0 110.693 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -66.46 -43.77 84.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -76.98 -49.38 15.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.543 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 m -74.14 -19.51 60.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.915 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt 67.44 7.11 5.33 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.249 0.619 . . . . 0.0 111.198 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.7 t -139.17 153.56 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.501 -0.772 . . . . 0.0 108.952 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.534 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -93.67 142.67 27.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.582 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 42.5 m-80 -131.19 112.42 12.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.12 0.486 . . . . 0.0 110.458 -173.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.7 mt -78.74 143.36 36.25 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.941 -177.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.466 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 28.0 m -125.59 123.0 38.08 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.336 0.588 . . . . 0.0 110.758 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.447 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 36.6 t -114.15 131.96 56.25 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.445 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.527 HD21 ' HE3' ' A' ' 67' ' ' LYS . 3.2 tm? -118.91 124.67 47.65 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 65' ' ' SER . 14.5 t -120.18 119.74 60.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.5 t -134.04 177.63 7.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.673 -173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 1.1 t30 58.5 45.93 15.72 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.558 0.536 . . . . 0.0 111.447 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.638 HD11 ' HE1' ' A' ' 89' ' ' HIS . 17.7 mt -71.48 146.36 48.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.209 -175.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.502 -171.206 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 6.0 m120 . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.521 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.0 mm -120.19 136.83 55.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.4 t -137.3 131.59 32.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.97 0.414 . . . . 0.0 110.382 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.489 ' HD1' HG22 ' A' ' 51' ' ' THR . 62.3 m95 -112.8 149.91 32.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.27 163.71 39.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.178 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.715 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 31.9 t -88.13 171.84 9.95 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.835 175.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -55.48 -29.94 59.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.137 0.494 . . . . 0.0 111.367 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -73.53 -8.62 56.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.922 0.392 . . . . 0.0 111.108 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.66 16.08 55.52 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.456 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.715 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 12.5 pt-20 -94.31 126.97 46.27 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -174.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.26 135.46 62.0 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.012 2.475 . . . . 0.0 113.565 -172.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.482 HD12 ' CD1' ' A' ' 83' ' ' PHE . 9.8 mt -97.37 147.8 23.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.02 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.69 106.51 3.55 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.886 0.851 . . . . 0.0 110.177 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.489 HG22 ' HD1' ' A' ' 41' ' ' TRP . 16.5 m . . . . . 0 C--N 1.31 -1.116 0 CA-C-N 113.908 -1.496 . . . . 0.0 109.382 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.547 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 14.6 m . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 121.273 0.559 . . . . 0.0 111.566 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.99 143.16 35.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 175.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.527 ' HE3' HD21 ' A' ' 27' ' ' LEU . 56.7 mttp -129.74 139.92 51.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -124.88 123.97 5.22 Favored Glycine 0 N--CA 1.44 -1.075 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.549 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 62.0 t -106.93 123.33 61.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.979 0.418 . . . . 0.0 109.971 -177.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.582 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -113.46 136.12 53.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.063 -177.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 p -98.16 113.54 25.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.493 -177.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.525 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.0 m -119.47 164.44 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.155 -175.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.477 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 42.5 m -74.99 140.67 43.79 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.451 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -61.54 -32.22 52.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.551 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.418 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 5.5 mm-40 -60.22 -33.94 72.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.229 177.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.477 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 4.7 m-20 -62.16 -44.81 95.78 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -74.31 -34.85 63.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.435 -179.733 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.418 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 82.7 m-20 -64.29 -32.54 74.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.756 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -92.56 6.65 46.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.928 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 58.33 38.25 25.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -66.05 166.09 12.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.406 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.407 ' HG3' ' HB2' ' A' ' 101' ' ' SER . 26.6 tt0 -123.27 139.19 54.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.084 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.482 ' CD1' HD12 ' A' ' 49' ' ' LEU . 79.2 m-85 -121.81 163.75 18.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.341 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.459 HG23 ' CD1' ' A' ' 99' ' ' PHE . 89.3 t -128.42 128.08 67.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.474 -176.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.723 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 25.9 p -105.89 142.81 34.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.52 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -123.53 127.31 48.15 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.493 HG12 HG12 ' A' ' 28' ' ' VAL . 60.3 t -106.47 127.26 61.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.079 -177.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -126.84 102.28 6.96 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.318 0.58 . . . . 0.0 109.493 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.768 ' HD2' ' HB2' ' A' ' 91' ' ' ASP . 40.9 t60 -98.52 -9.99 24.16 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.04 -174.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.07 11.43 6.95 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.831 0.824 . . . . 0.0 109.042 -174.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.768 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 7.0 t70 -92.66 -37.25 12.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.5 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -122.63 155.57 62.71 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.733 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.43 -31.79 10.87 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.811 2.341 . . . . 0.0 112.551 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.415 ' O ' HD11 ' A' ' 92' ' ' LEU . 22.2 p -113.04 110.25 51.57 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.63 -177.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.52 ' HB2' HG23 ' A' ' 86' ' ' THR . 27.5 Cg_endo -62.64 141.79 87.15 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.765 2.31 . . . . 0.0 111.892 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.15 136.16 34.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.45 -176.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -107.22 132.61 52.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.212 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.723 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -124.95 140.86 52.54 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.725 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.647 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 70.3 m-85 -104.83 141.08 37.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.142 -177.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.4 tt -140.5 137.32 36.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.805 0.336 . . . . 0.0 110.602 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.407 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 22.8 t -157.89 150.33 22.46 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 1.1 tmmt? . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.336 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 . . . . . 0 CA--C 1.516 -0.334 0 CA-C-O 121.378 0.608 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.547 HG21 HD21 ' A' ' 31' ' ' LEU . 81.9 mt -60.32 122.29 10.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.792 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.6 mt -107.63 132.2 53.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.145 0.497 . . . . 0.0 110.877 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.499 HG23 HG22 ' A' ' 87' ' ' VAL . 33.4 p -107.66 127.11 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.268 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.658 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 93.0 m-85 -124.73 152.8 43.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.709 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.0 p -134.12 138.29 45.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.574 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.413 HD13 ' N ' ' A' ' 9' ' ' ILE . 4.1 mp -117.9 123.06 29.93 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.606 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.524 ' HA ' HD12 ' A' ' 100' ' ' ILE . 72.1 Cg_endo -75.32 140.15 24.27 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.129 2.552 . . . . 0.0 111.819 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.86 150.56 61.69 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.289 1.993 . . . . 0.0 111.754 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -78.73 144.7 34.99 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.114 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.647 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 67.3 t80 -62.39 -31.33 71.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.089 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.03 93.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.312 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.68 -47.24 84.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.974 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.35 -34.14 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.497 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -73.28 -45.69 54.23 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.758 -175.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.0 -49.37 37.59 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.669 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.8 m -80.38 -15.83 55.91 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.158 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.8 mttp 62.16 19.6 11.04 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.299 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.7 m -141.09 154.72 46.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.372 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.747 ' HB1' HG13 ' A' ' 72' ' ' VAL . . . -104.53 162.39 13.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -146.84 145.91 30.03 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 69.4 mt -107.17 128.01 54.02 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.233 -177.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.7 m -115.54 126.8 54.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.163 0.506 . . . . 0.0 111.098 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.662 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 32.7 t -126.62 138.45 53.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.488 HD13 ' HG2' ' A' ' 67' ' ' LYS . 2.5 tt -132.34 135.82 46.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.235 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.456 ' O ' ' HB3' ' A' ' 65' ' ' SER . 42.1 t -118.18 125.59 74.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.372 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.4 m -127.94 176.38 7.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.295 -176.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 59.66 41.34 18.79 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.101 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.547 HD21 HG21 ' A' ' 4' ' ' ILE . 34.7 mt -80.49 126.85 31.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.549 177.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.634 -178.149 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.8 m120 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.494 HG22 ' HA3' ' A' ' 68' ' ' GLY . 20.6 mm -119.36 134.97 61.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 172.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.7 t -143.34 126.99 17.0 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.069 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.662 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 87.7 m95 -105.15 148.35 26.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.2 0.524 . . . . 0.0 110.382 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.56 158.23 40.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.507 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.3 t -75.68 162.58 28.11 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -58.09 -25.16 60.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.258 0.551 . . . . 0.0 110.296 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.3 m -72.95 -8.56 56.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.133 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.17 19.2 43.3 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.283 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -100.03 123.57 46.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.516 0.198 . . . . 0.0 110.868 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.08 141.69 96.77 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.317 2.678 . . . . 0.0 113.276 -176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mt -113.21 147.38 37.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.168 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 21.9 tt0 -56.78 107.52 0.4 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.587 176.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.299 178.742 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.456 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 2.0 m . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.486 0.66 . . . . 0.0 111.975 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.456 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -108.27 149.3 28.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.071 174.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.488 ' HG2' HD13 ' A' ' 27' ' ' LEU . 28.9 mtpp -131.69 139.37 49.02 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.494 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -137.36 129.2 4.61 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.926 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 42.1 t -115.23 132.06 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.788 0.328 . . . . 0.0 110.714 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.32 151.65 35.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.167 177.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -99.33 120.74 40.06 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.592 0.71 . . . . 0.0 110.38 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.747 HG13 ' HB1' ' A' ' 22' ' ' ALA . 2.0 t -124.25 151.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.083 -174.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -88.57 153.27 21.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -60.87 -36.75 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.191 0.52 . . . . 0.0 109.98 -177.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 9.9 mm-40 -57.54 -33.88 68.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.778 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.21 -48.33 80.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.545 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -68.78 -36.24 78.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.756 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 87.6 m-20 -64.24 -34.35 77.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.974 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -87.53 7.12 30.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.666 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 80' ' ' ARG . 23.2 mmt180 56.58 37.81 29.11 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.76 178.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -63.5 159.08 19.31 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.651 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -111.63 138.07 48.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.842 175.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -122.42 154.26 37.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.29 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.503 HG23 ' CD1' ' A' ' 99' ' ' PHE . 86.2 t -123.59 128.19 74.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -173.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.756 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 28.9 p -106.15 140.27 39.38 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.447 HG21 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -119.19 127.02 52.91 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.773 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.499 HG22 HG23 ' A' ' 6' ' ' THR . 58.6 t -110.26 133.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.817 -178.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.0 p -139.06 100.67 4.09 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.176 0.512 . . . . 0.0 111.066 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.507 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 50.2 t60 -98.4 -8.19 27.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.03 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.507 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 52.2 ttt180 79.7 -27.6 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.782 0.676 . . . . 0.0 110.738 -176.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 89' ' ' HIS . 11.9 t70 -71.17 -33.11 69.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.087 0.47 . . . . 0.0 110.75 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 92' ' ' LEU . 0.9 OUTLIER -87.89 146.44 38.78 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-O 121.203 0.525 . . . . 0.0 110.752 177.489 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.62 -19.54 11.31 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.288 2.658 . . . . 0.0 112.813 -175.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 20.1 m -141.25 132.52 13.53 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.555 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -61.85 140.99 88.38 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.497 2.131 . . . . 0.0 111.514 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -92.75 128.56 38.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.903 0.382 . . . . 0.0 110.456 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.447 ' HG2' HG21 ' A' ' 86' ' ' THR . 56.5 mtpt -106.11 141.62 37.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.679 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.756 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 30.3 mmtm -129.85 138.98 51.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.292 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.503 ' CD1' HG23 ' A' ' 84' ' ' VAL . 15.7 m-30 -100.98 137.56 39.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.86 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 ' HA ' ' A' ' 10' ' ' PRO . 13.6 tt -130.48 139.45 51.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.958 0.409 . . . . 0.0 110.722 177.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.5 p -157.38 148.7 21.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.219 176.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.454 ' HB2' ' NE1' ' A' ' 77' ' ' TRP . 27.1 tptp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.687 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 CA--C 1.518 -0.258 0 CA-C-O 121.152 0.501 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.533 HG21 HD21 ' A' ' 31' ' ' LEU . 84.0 mt -63.29 135.95 26.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.437 174.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.6 mt -104.54 130.79 52.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.929 0.395 . . . . 0.0 110.29 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.0 p -116.86 122.57 44.74 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.14 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.657 ' HD1' ' CD2' ' A' ' 7' ' ' PHE . 98.1 m-85 -121.1 133.92 55.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.48 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 p -112.14 134.48 53.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.22 176.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.428 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 34.0 mm -117.42 119.93 33.89 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.574 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 18.1 Cg_endo -58.31 139.59 91.12 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.996 2.464 . . . . 0.0 111.802 173.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.512 ' HB2' HD12 ' A' ' 16' ' ' ILE . 43.6 Cg_endo -65.96 153.14 79.34 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 123.118 2.546 . . . . 0.0 112.905 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.501 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.0 t -81.09 121.41 26.06 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 178.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.596 ' HE1' ' CE2' ' A' ' 13' ' ' PHE . 51.8 t80 -62.83 -34.08 76.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.105 -173.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.98 -46.41 89.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.449 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.25 -38.86 88.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.568 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.559 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.6 mt -58.9 -40.68 80.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.52 176.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.661 ' HE1' ' CE2' ' A' ' 17' ' ' PHE . 47.7 t80 -73.6 -43.56 59.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.073 -176.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.86 -48.71 77.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.952 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.2 p -86.94 -13.95 43.22 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.176 0.512 . . . . 0.0 111.07 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.81 27.06 16.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.049 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.4 m -139.08 134.0 32.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.144 174.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.559 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -87.51 142.65 27.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 39.2 m-80 -126.55 118.41 24.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.009 0.433 . . . . 0.0 110.091 -173.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.541 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 86.9 mt -82.82 139.15 33.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.959 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.2 m -124.9 120.62 32.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.477 0.656 . . . . 0.0 110.937 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.556 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 42.5 t -121.48 136.67 54.94 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.413 178.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.479 ' HG ' ' OG ' ' A' ' 65' ' ' SER . 2.7 tt -131.81 130.75 42.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.499 HG12 HG22 ' A' ' 87' ' ' VAL . 12.8 t -120.76 119.5 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.687 -176.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.1 p -130.86 177.13 7.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.043 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.2 45.28 17.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.298 0.57 . . . . 0.0 111.189 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.533 HD21 HG21 ' A' ' 4' ' ' ILE . 25.4 mt -78.16 110.5 13.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.352 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.407 -172.426 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.5 m120 . . . . . 0 N--CA 1.441 -0.912 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.498 HG22 ' HA3' ' A' ' 68' ' ' GLY . 16.0 mm -119.21 134.79 61.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 175.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.2 t -141.26 129.89 22.75 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 119.666 -0.814 . . . . 0.0 111.508 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.556 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -105.48 146.88 28.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.687 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.51 164.19 38.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.701 179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.8 p -75.52 170.6 15.82 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -58.45 -28.51 65.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.139 0.495 . . . . 0.0 110.818 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.0 m -75.62 -8.21 56.22 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.219 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.7 21.43 43.49 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.347 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 0.8 OUTLIER -96.64 122.9 55.88 Favored Pre-proline 0 N--CA 1.443 -0.775 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 38.1 Cg_exo -59.78 139.63 89.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 123.024 2.483 . . . . 0.0 113.875 -172.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 49' ' ' LEU . 7.1 mt -105.74 145.02 31.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.604 174.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -63.12 105.8 0.76 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.335 0.588 . . . . 0.0 110.325 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.407 HG21 ' HD1' ' A' ' 41' ' ' TRP . 9.2 m . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.269 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.479 ' OG ' ' HG ' ' A' ' 27' ' ' LEU . 33.0 t . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 120.79 0.328 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.497 ' HB2' HD12 ' A' ' 39' ' ' ILE . . . -109.66 155.74 21.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.482 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -129.72 139.44 51.33 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 176.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.498 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -121.93 118.76 3.8 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 58.5 t -107.84 122.95 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.748 0.308 . . . . 0.0 110.451 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.412 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.33 141.06 48.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.902 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -98.87 114.6 27.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.28 0.562 . . . . 0.0 110.326 -177.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 2.5 m -119.73 166.77 13.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.774 -177.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.4 m -79.13 144.89 34.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.905 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 t -57.24 -30.85 36.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 173.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.96 -39.58 90.1 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.473 177.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -61.81 -42.35 98.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.542 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -73.02 -39.19 66.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 179.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -68.9 -23.95 64.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.639 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -98.02 16.8 19.97 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.423 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 17.4 mmt180 55.59 36.71 27.72 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.969 173.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -71.98 157.59 37.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.373 0.606 . . . . 0.0 111.958 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.4 mp0 -109.23 139.11 44.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.433 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.655 ' HD2' ' CD1' ' A' ' 83' ' ' PHE . 71.8 m-85 -125.37 151.81 45.62 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.219 178.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.9 t -122.2 122.74 67.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.399 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.713 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 20.6 p -105.6 133.37 50.45 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.535 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -126.4 128.38 46.93 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -178.076 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.499 HG22 HG12 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -119.84 127.41 75.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.039 0.447 . . . . 0.0 112.155 -174.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.0 m -112.18 108.51 17.79 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.191 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -101.21 -8.81 21.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.091 177.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 74.15 -3.84 2.43 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.333 0.587 . . . . 0.0 110.317 -175.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.495 ' HB3' HD12 ' A' ' 4' ' ' ILE . 5.5 t70 -73.23 -36.32 66.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.569 -177.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -122.61 154.16 63.12 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.577 -176.563 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -68.08 -20.69 43.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.254 2.636 . . . . 0.0 112.476 -176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.48 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 13.7 m -129.04 111.37 18.4 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.259 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.535 ' HB2' HG23 ' A' ' 86' ' ' THR . 11.8 Cg_endo -55.21 148.45 49.76 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.722 2.281 . . . . 0.0 110.919 174.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 86' ' ' THR . 40.9 mt-30 -90.8 127.42 36.34 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.759 -171.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.597 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 15.9 ptmt -110.14 129.92 55.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.304 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.713 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 67.6 mmtt -122.92 140.9 52.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.686 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.602 ' HE2' ' CE1' ' A' ' 99' ' ' PHE . 89.2 m-85 -100.68 122.99 44.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.368 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.9 tt -122.86 139.29 50.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.52 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 3.7 p -157.47 148.87 21.82 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.245 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.542 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 49.5 tttp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.098 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 CA--C 1.517 -0.322 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.439 HG21 HD21 ' A' ' 31' ' ' LEU . 59.6 mt -66.95 120.5 14.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.391 0.432 . . . . 0.0 110.237 -176.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.5 mt -108.77 134.41 51.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.17 0.509 . . . . 0.0 111.192 -175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.497 ' HB ' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -107.39 127.72 53.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.112 -177.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.668 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 94.9 m-85 -127.34 143.15 51.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -119.63 137.86 53.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.742 0.306 . . . . 0.0 110.664 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.17 123.46 30.05 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.995 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.515 ' HA ' HD12 ' A' ' 100' ' ' ILE . 61.1 Cg_endo -70.91 148.73 58.22 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 123.124 2.549 . . . . 0.0 112.066 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.25 149.33 81.38 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.585 2.19 . . . . 0.0 111.75 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 16' ' ' ILE . 2.8 t -103.27 143.99 31.93 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -58.23 -30.59 66.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.458 -172.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.452 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -67.75 -44.18 78.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.782 0.325 . . . . 0.0 110.314 175.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.82 -45.95 91.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.16 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 12' ' ' SER . 51.9 mt -61.01 -29.89 46.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.363 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.95 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -72.3 -43.92 63.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.109 0.48 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.452 HD21 ' O ' ' A' ' 14' ' ' ALA . 4.3 mm? -67.27 -49.53 63.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.262 -176.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 p -93.82 0.84 56.46 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 87.2 tttt 69.51 -48.9 0.61 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.4 0.68 . . . . 0.0 111.165 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 13.8 m -89.38 151.21 22.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.916 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.3 155.88 24.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.209 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -129.86 126.41 37.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.064 0.459 . . . . 0.0 110.588 -176.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.411 HD23 HD11 ' A' ' 100' ' ' ILE . 52.7 mt -89.39 138.45 31.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.81 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.541 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 19.2 m -120.8 129.2 53.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.018 0.437 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 47.0 t -109.75 137.38 47.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.169 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 2.8 tm? -126.34 123.73 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 87' ' ' VAL . 15.4 t -123.89 119.63 57.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.9 p -133.71 177.39 7.75 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -173.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 59.46 40.74 20.32 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.428 177.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.439 HD21 HG21 ' A' ' 4' ' ' ILE . 58.6 mt -64.1 127.43 31.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.187 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.651 -179.326 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.519 HG22 ' HA3' ' A' ' 68' ' ' GLY . 27.8 mm -121.86 151.91 25.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -177.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 37.3 m -149.98 123.74 9.23 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.084 -0.385 . . . . 0.0 111.109 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.437 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 67.4 m95 -107.76 144.87 34.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.174 0.512 . . . . 0.0 111.246 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.76 157.07 34.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.067 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.657 ' HB2' ' CG ' ' A' ' 47' ' ' GLU . 14.7 m -88.26 162.65 16.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.046 0.45 . . . . 0.0 109.926 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.3 -25.05 8.52 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.891 -1.05 . . . . 0.0 113.821 -170.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -88.1 -0.78 57.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.857 0.361 . . . . 0.0 111.403 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.16 22.16 28.18 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.324 -0.465 . . . . 0.0 112.061 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.657 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 8.2 pt-20 -100.4 128.76 29.51 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.731 0.301 . . . . 0.0 110.595 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 35.7 Cg_exo -61.13 141.55 94.08 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.33 2.687 . . . . 0.0 113.77 -173.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.492 HD12 ' CD1' ' A' ' 83' ' ' PHE . 8.5 mt -108.19 147.71 30.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.959 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 4.2 mp0 -62.39 106.2 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.632 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.321 -0.637 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.801 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 17.3 m . . . . . 0 CA--C 1.533 0.308 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.69 146.0 31.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.861 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 55.6 mtpt -132.48 140.76 48.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.462 -175.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.519 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -129.33 139.37 10.91 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 53.6 t -114.44 124.5 71.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.0 0.429 . . . . 0.0 110.79 -174.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.407 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -115.69 134.64 54.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.83 177.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.8 m -98.92 123.38 43.16 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.081 0.467 . . . . 0.0 110.166 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.437 ' O ' ' HB3' ' A' ' 21' ' ' SER . 4.0 m -122.03 165.32 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.929 -175.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.1 t -86.69 150.06 24.45 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 t -63.82 -24.28 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -65.14 -36.53 84.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.731 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 59.7 m-20 -68.18 -44.67 75.4 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.448 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -69.18 -35.28 76.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.478 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -70.54 -27.7 64.35 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.587 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -92.94 7.67 43.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.918 0.39 . . . . 0.0 110.326 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.9 mtt-85 58.34 37.49 25.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.28 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 53.3 mtpt -67.1 156.48 36.03 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.977 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.51 139.23 43.55 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.273 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 49' ' ' LEU . 64.8 m-85 -124.71 150.62 45.98 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.128 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 94.7 t -125.27 131.47 72.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.752 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 30.6 p -106.31 126.28 52.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.539 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 p -112.05 137.64 49.81 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.658 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 28' ' ' VAL . 44.7 t -116.59 127.42 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.603 -175.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . 0.501 HG21 ' HB3' ' A' ' 95' ' ' PRO . 1.4 p -119.02 94.22 4.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.684 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 1.3 t60 -85.34 -50.78 7.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.33 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.684 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 3.2 tmm_? 151.69 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.758 1.286 . . . . 0.0 108.307 -176.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -71.37 -30.41 66.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.662 -1.154 . . . . 0.0 112.177 -167.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.32 148.23 43.41 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-O 121.105 0.479 . . . . 0.0 111.067 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -78.61 -26.86 5.47 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.271 2.647 . . . . 0.0 111.96 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.6 p -118.39 122.3 30.28 Favored Pre-proline 0 N--CA 1.445 -0.684 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.518 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.525 ' HB2' ' HB ' ' A' ' 86' ' ' THR . 18.7 Cg_endo -60.5 140.72 92.83 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.198 1.932 . . . . 0.0 111.997 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.539 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.9 pt20 -78.94 135.11 36.86 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -113.31 128.01 56.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.315 0.579 . . . . 0.0 111.782 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.497 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 6.2 tmtt? -121.98 140.91 51.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.178 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -100.35 147.55 25.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.836 0.35 . . . . 0.0 111.101 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 10' ' ' PRO . 12.6 tt -133.77 138.55 50.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.455 176.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 56.9 p -158.3 149.94 21.34 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.65 -0.69 . . . . 0.0 110.26 179.254 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 120.689 0.281 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.538 HG21 HD21 ' A' ' 31' ' ' LEU . 69.3 mt -60.39 121.81 9.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.308 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 83.4 mt -108.95 140.32 42.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.003 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.51 ' HB ' HG22 ' A' ' 87' ' ' VAL . 2.5 t -134.21 125.41 27.76 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.202 0.525 . . . . 0.0 110.517 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -121.52 141.9 50.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.483 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.446 ' HB ' HD13 ' A' ' 100' ' ' ILE . 16.7 p -113.55 132.44 55.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.012 0.434 . . . . 0.0 111.48 -178.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.44 124.34 29.07 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.089 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -77.91 145.0 22.08 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 123.153 2.569 . . . . 0.0 112.267 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.0 147.76 49.72 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 122.453 2.102 . . . . 0.0 111.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.91 155.17 16.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.096 -176.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -56.47 -43.97 80.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.555 0.217 . . . . 0.0 111.487 -173.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -45.89 92.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.149 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.22 -40.06 95.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.045 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.36 -30.58 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.704 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.658 ' HE2' ' CE1' ' A' ' 17' ' ' PHE . 43.6 t80 -71.85 -43.96 64.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.853 -174.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.45 -48.15 61.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.734 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.5 p -80.91 -13.09 59.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.54 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 60.16 21.26 10.56 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.865 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.3 m -137.82 137.75 38.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.349 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.561 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -97.12 148.91 22.56 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.548 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.4 p30 -157.73 127.73 6.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.001 0.429 . . . . 0.0 110.484 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.447 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -84.41 146.94 27.39 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.063 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.7 m -124.22 120.97 33.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.169 0.509 . . . . 0.0 111.154 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.564 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.4 t -113.27 137.69 51.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.597 HD13 ' HG2' ' A' ' 67' ' ' LYS . 1.2 tt -131.9 138.08 48.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.854 0.359 . . . . 0.0 110.629 175.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.583 HG23 ' H ' ' A' ' 66' ' ' ALA . 4.4 m -115.03 147.1 18.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.539 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.3 p -143.19 175.25 10.02 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.708 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 59.1 31.99 21.77 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.538 HD21 HG21 ' A' ' 4' ' ' ILE . 49.5 mt -71.34 118.36 14.04 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.111 0 CA-C-O 121.163 0.506 . . . . 0.0 110.573 -179.557 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.446 -0.661 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.51 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.1 mm -120.87 135.23 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 t -138.73 147.46 42.72 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.564 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -123.7 149.3 45.67 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.372 177.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -147.07 150.93 36.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 m -74.73 150.6 39.38 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.529 HE22 ' HD1' ' A' ' 99' ' ' PHE . 8.8 tp-100 -52.59 -24.7 8.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.6 p -73.5 -6.72 48.23 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.175 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.24 19.92 37.39 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.99 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -100.02 121.5 53.74 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.55 139.6 71.01 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.826 2.351 . . . . 0.0 112.93 -175.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 49' ' ' LEU . 10.5 mt -107.07 145.43 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.596 178.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -72.0 106.85 4.44 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.929 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.44 -176.334 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.531 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 32.7 t . . . . . 0 N--CA 1.448 -0.563 0 CA-C-O 120.977 0.418 . . . . 0.0 111.963 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.583 ' H ' HG23 ' A' ' 28' ' ' VAL . . . -132.73 155.93 47.96 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.236 170.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.597 ' HG2' HD13 ' A' ' 27' ' ' LEU . 29.5 mtpp -131.93 140.18 48.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.51 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -138.95 132.51 5.76 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.354 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 60.9 t -116.53 133.33 63.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.896 0.379 . . . . 0.0 110.525 -177.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.548 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.06 139.33 49.96 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.611 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.3 m -97.69 119.0 35.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.005 0.431 . . . . 0.0 110.544 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.561 HG21 ' HB1' ' A' ' 22' ' ' ALA . 11.7 m -130.49 166.53 27.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.859 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.73 150.83 36.23 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.2 t -61.0 -32.98 53.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.73 0.776 . . . . 0.0 109.151 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -56.85 -38.81 73.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.94 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.08 -41.08 91.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 -175.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -34.31 62.71 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.673 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -69.91 -20.38 63.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.656 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -102.3 8.16 40.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.023 0.439 . . . . 0.0 110.772 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 59.74 38.12 21.82 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.753 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -63.58 164.09 10.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.094 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.499 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 42.1 mp0 -107.64 137.17 46.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.602 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 100' ' ' ILE . 60.0 m-85 -129.58 148.24 51.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.875 174.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 2.6 p -133.19 135.12 57.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.4 p -104.74 142.92 33.85 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.111 0.481 . . . . 0.0 110.808 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.512 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -113.96 130.22 56.54 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.732 176.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.51 HG22 ' HB ' ' A' ' 6' ' ' THR . 59.0 t -104.64 127.15 59.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.783 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 m -127.47 94.5 4.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.424 0.63 . . . . 0.0 110.726 -173.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 91' ' ' ASP . 1.4 t60 -99.54 -10.84 21.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.045 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.4 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER 69.89 -6.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.692 0.758 . . . . 0.0 109.552 -172.609 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.494 ' H ' ' C ' ' A' ' 89' ' ' HIS . 19.8 t70 -72.82 -29.43 63.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.32 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 154.47 52.46 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.319 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.64 -20.33 17.89 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.118 2.545 . . . . 0.0 112.937 -177.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.424 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 52.1 p -132.13 118.57 16.32 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 18.6 Cg_endo -58.22 141.11 96.46 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.749 2.299 . . . . 0.0 111.362 177.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.512 ' O ' ' HA ' ' A' ' 86' ' ' THR . 45.4 mt-30 -83.9 149.71 26.18 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.636 -177.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 28.3 mtpp -125.74 137.31 53.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 -176.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.658 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 71.3 mmtt -129.9 133.96 47.19 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.529 ' HD1' HE22 ' A' ' 44' ' ' GLN . 42.3 m-85 -101.23 124.41 46.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.33 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.529 HG23 ' O ' ' A' ' 83' ' ' PHE . 13.0 tt -122.0 141.3 42.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.896 0.379 . . . . 0.0 111.15 -178.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.499 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 22.8 p -156.86 149.53 23.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.469 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.921 -0.561 . . . . 0.0 109.489 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 120.67 0.272 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.487 HG21 HD21 ' A' ' 31' ' ' LEU . 28.2 mt -62.18 121.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.591 -176.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.5 mt -115.49 132.83 56.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.1 t -121.31 130.54 53.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.623 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 85.6 m-85 -125.0 146.65 49.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.519 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.1 p -116.41 137.79 51.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.061 0.458 . . . . 0.0 111.12 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -117.89 126.6 27.18 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.974 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HA ' HD12 ' A' ' 100' ' ' ILE . 96.0 Cg_endo -78.7 148.36 22.69 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 123.048 2.499 . . . . 0.0 112.55 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -77.51 150.16 27.91 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.601 2.201 . . . . 0.0 111.506 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.475 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.7 t -88.97 149.14 23.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.512 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 76.2 t80 -54.3 -43.31 71.01 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -174.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' HD11 ' A' ' 18' ' ' LEU . . . -60.97 -46.26 91.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.421 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.92 -37.15 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.176 -177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 12' ' ' SER . 71.0 mt -61.46 -36.92 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.079 0.466 . . . . 0.0 110.434 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.634 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 56.7 t80 -72.22 -43.82 63.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.187 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD11 ' O ' ' A' ' 14' ' ' ALA . 10.8 mp -66.92 -48.45 68.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.235 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.483 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -75.51 -12.81 60.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.476 -178.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 70.79 -10.65 0.71 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.298 0.639 . . . . 0.0 111.131 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 19' ' ' SER . 10.0 p -138.72 147.38 42.65 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.233 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.606 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -88.08 156.78 19.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.629 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 31.1 m-80 -139.42 116.84 11.3 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.639 -171.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.585 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.43 144.1 44.43 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 174.587 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.499 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 39.1 m -125.27 124.21 41.16 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.086 0.47 . . . . 0.0 110.415 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 26.2 t -112.1 136.93 50.86 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.818 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -125.08 122.68 37.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.435 ' O ' ' HA ' ' A' ' 65' ' ' SER . 24.3 t -121.98 126.42 74.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.7 m -139.14 176.39 8.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.383 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 57.32 50.61 11.23 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.86 0.725 . . . . 0.0 111.242 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.487 HD21 HG21 ' A' ' 4' ' ' ILE . 65.2 mt -74.66 149.55 39.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.742 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.9 -177.53 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.5 m120 . . . . . 0 C--O 1.234 0.252 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.548 HG22 ' HA3' ' A' ' 68' ' ' GLY . 22.7 mm -122.14 137.63 55.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 t -136.26 143.77 44.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.685 0.279 . . . . 0.0 110.369 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 66.7 m95 -129.15 145.82 51.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.981 0.419 . . . . 0.0 110.785 177.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.78 139.82 17.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.591 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.524 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 29.5 t -66.36 155.26 37.86 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.117 0.484 . . . . 0.0 110.387 174.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -62.89 -24.1 67.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.185 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.4 m -76.67 -3.77 39.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.051 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.83 21.7 38.78 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.755 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 21.5 mt-10 -92.67 121.1 66.8 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 17.1 Cg_exo -66.12 134.23 35.96 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.932 1.755 . . . . 0.0 111.419 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.899 HD13 ' HB2' ' A' ' 70' ' ' ALA . 1.7 mm? -102.68 141.48 35.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.302 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -92.01 107.4 19.18 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.656 176.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.0 m . . . . . 0 C--N 1.319 -0.732 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.832 -174.563 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 1.4 m . . . . . 0 N--CA 1.445 -0.689 0 CA-C-O 121.515 0.674 . . . . 0.0 112.305 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.54 149.81 29.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.064 164.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 39.5 mtpt -131.94 141.24 49.26 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.548 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -137.63 131.66 5.59 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.6 -177.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -122.93 124.13 69.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.989 0.423 . . . . 0.0 110.632 -177.139 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.899 ' HB2' HD13 ' A' ' 49' ' ' LEU . . . -116.36 147.38 41.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.351 -176.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -104.85 123.64 48.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.988 0.423 . . . . 0.0 111.309 -172.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.606 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 6.4 m -125.38 164.4 24.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.281 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.4 t -82.21 153.72 25.8 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.47 -33.75 52.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.154 0.502 . . . . 0.0 110.256 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -59.93 -33.34 71.76 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.863 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 15.6 m-20 -64.55 -42.43 95.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.436 0.636 . . . . 0.0 109.387 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.0 OUTLIER -74.03 -35.44 64.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.546 179.071 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -64.23 -33.42 75.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.341 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -90.72 8.23 35.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.112 0.482 . . . . 0.0 110.663 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 54.5 38.28 29.42 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.345 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 57.3 mtpt -66.36 159.81 26.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.751 175.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -118.08 141.22 48.71 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.972 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 96.6 m-85 -120.04 151.57 38.81 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.224 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.9 t -121.42 129.41 75.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.583 -173.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.604 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 45.1 t -105.77 122.39 46.0 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.496 -0.482 . . . . 0.0 109.714 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.8 112.2 25.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.185 0.517 . . . . 0.0 110.701 176.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.421 ' HB ' ' CG ' ' A' ' 96' ' ' GLN . 43.2 t -97.53 125.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.126 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.5 m -118.46 112.81 20.44 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.619 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.473 ' HB3' ' OD1' ' A' ' 91' ' ' ASP . 7.3 t-160 -97.98 -50.4 4.42 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.058 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 42.4 ttm180 144.89 -33.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 O-C-N 125.396 1.685 . . . . 0.0 109.947 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.473 ' OD1' ' HB3' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -72.04 -35.19 69.27 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.959 -168.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.64 146.05 32.39 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 121.426 0.631 . . . . 0.0 111.301 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.14 -19.24 26.42 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 123.54 2.827 . . . . 0.0 112.466 -174.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 24.0 t -144.13 135.54 12.69 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.74 141.4 95.61 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.047 2.498 . . . . 0.0 112.396 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' CG ' ' HB ' ' A' ' 87' ' ' VAL . 3.5 pt20 -81.42 133.25 35.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.818 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.604 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.3 ptpt -114.82 142.71 46.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.304 0.574 . . . . 0.0 111.707 -175.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 32.7 mmtm -129.73 140.0 51.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.232 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.661 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 79.3 m-85 -101.36 133.45 45.94 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.035 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 10' ' ' PRO . 12.4 tt -128.68 136.3 60.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.996 0.426 . . . . 0.0 111.182 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.3 p -158.74 146.72 18.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.074 176.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.633 -176.484 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.536 HG21 HD23 ' A' ' 31' ' ' LEU . 68.1 mt -60.37 129.08 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 169.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.3 mt -104.1 128.82 51.76 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.156 -171.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.412 HG21 ' HD3' ' A' ' 98' ' ' LYS . 4.1 t -120.3 129.31 53.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.717 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -131.13 141.98 50.19 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.738 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 p -113.08 133.63 54.91 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.848 176.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.424 HD13 ' N ' ' A' ' 9' ' ' ILE . 4.3 mp -116.58 124.8 29.01 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.051 -175.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.543 ' HA ' HD12 ' A' ' 100' ' ' ILE . 52.5 Cg_endo -69.57 139.1 40.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.694 2.262 . . . . 0.0 111.687 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.493 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 55.7 Cg_endo -65.82 144.17 76.35 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.886 2.39 . . . . 0.0 111.837 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.1 m -85.64 148.59 25.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.641 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -54.71 -42.38 71.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.727 0.24 . . . . 0.0 111.275 -173.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' HD11 ' A' ' 18' ' ' LEU . . . -57.81 -45.1 86.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.325 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.83 -42.19 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.85 0.357 . . . . 0.0 110.817 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 21' ' ' SER . 62.1 mt -66.15 -38.82 82.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.661 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -74.03 -43.25 58.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.12 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.45 HD11 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -64.25 -47.7 78.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.727 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 78.6 p -85.98 -12.31 50.71 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.233 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 65.47 17.43 10.95 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.742 -176.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 23.1 m -139.13 147.21 41.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.394 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.555 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -92.04 136.72 32.95 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -114.17 122.95 48.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.635 -173.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.462 ' HB2' ' HB1' ' A' ' 70' ' ' ALA . 83.4 mt -85.3 125.4 32.89 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.668 177.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.9 m -113.64 123.98 51.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.314 0.578 . . . . 0.0 111.434 -176.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.552 ' HB3' HD13 ' A' ' 39' ' ' ILE . 18.2 t -124.38 137.05 54.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.656 176.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.51 124.22 26.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.1 t -119.2 129.92 74.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.5 p -143.19 177.37 8.45 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.228 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 15.2 m120 62.53 50.33 3.64 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.706 0.765 . . . . 0.0 109.772 174.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.536 HD23 HG21 ' A' ' 4' ' ' ILE . 0.9 OUTLIER -74.56 65.9 1.34 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.869 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.553 0 CA-C-N 113.641 -1.618 . . . . 0.0 109.883 177.526 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.623 ' N ' ' HB ' ' A' ' 87' ' ' VAL . 63.7 t30 . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.552 HD13 ' HB3' ' A' ' 26' ' ' CYS . 14.7 mm -122.9 130.47 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 C-N-CA 118.77 -1.172 . . . . 0.0 109.794 169.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.8 t -155.53 121.88 5.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 78.0 m95 -103.04 142.27 34.39 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.447 0.641 . . . . 0.0 111.663 -174.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.05 164.97 36.11 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.116 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.468 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 86.9 p -82.17 168.39 17.74 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 177.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -63.7 -22.82 67.1 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.292 0.567 . . . . 0.0 110.259 174.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -87.43 -5.49 58.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.222 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.36 22.37 29.59 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.793 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.468 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 6.5 pt-20 -93.09 133.14 29.21 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 117.449 0.624 . . . . 0.0 109.433 176.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 16.3 Cg_exo -67.8 136.52 38.98 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.689 2.259 . . . . 0.0 112.306 -177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.438 HD21 ' HA ' ' A' ' 49' ' ' LEU . 11.2 mt -109.02 140.83 42.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.785 178.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.35 107.22 0.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.475 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 7.8 m . . . . . 0 C--N 1.313 -0.988 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.745 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.163 0.506 . . . . 0.0 112.193 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.26 135.35 50.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.076 168.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -131.14 138.88 49.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.532 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -144.89 141.22 9.77 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 48.0 t -123.67 133.74 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.629 0.252 . . . . 0.0 110.739 -174.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.462 ' HB1' ' HB2' ' A' ' 24' ' ' LEU . . . -116.15 142.61 46.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 p -100.0 115.46 29.75 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.956 0.408 . . . . 0.0 111.175 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.555 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 1.9 m -119.44 166.47 13.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.867 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.1 t -81.02 151.89 28.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.24 -24.99 36.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.86 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.71 -34.76 77.52 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.987 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.41 -49.75 76.58 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.453 0.644 . . . . 0.0 109.778 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.565 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -67.78 -34.26 76.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.753 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -68.97 -30.37 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.26 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -92.93 8.58 39.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.325 . . . . 0.0 110.602 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 59.89 36.76 21.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.475 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -63.41 154.67 31.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.298 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -118.27 139.31 51.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.558 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.596 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 87.5 m-85 -122.64 162.85 21.13 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.49 -176.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.7 t -131.35 126.35 58.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.984 -175.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 45.9 t -111.44 123.51 50.36 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -110.68 125.62 53.65 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.623 ' HB ' ' N ' ' A' ' 38' ' ' ASN . 1.6 m -107.23 145.63 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.152 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.233 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -143.45 81.2 1.7 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.521 0.676 . . . . 0.0 112.537 -164.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.474 ' HD2' ' HB2' ' A' ' 91' ' ' ASP . 35.4 t60 -82.63 -9.15 59.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.54 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.14 21.07 12.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -170.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.474 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 9.2 t70 -84.46 -33.48 23.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.369 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.53 163.11 52.19 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.167 -179.399 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.23 -31.13 14.89 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.51 2.14 . . . . 0.0 112.651 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.435 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 3.9 p -109.5 102.49 49.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.474 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 37.9 Cg_endo -64.11 152.38 81.31 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 123.198 2.599 . . . . 0.0 111.666 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.424 ' O ' ' HA ' ' A' ' 86' ' ' THR . 35.6 mt-30 -95.82 130.51 42.73 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.052 -175.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -105.78 132.85 51.41 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.893 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.577 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 3.5 mmmp? -114.52 137.51 51.76 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.544 -178.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -101.28 138.85 37.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.811 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 10' ' ' PRO . 11.4 tt -144.24 137.64 23.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 p -157.51 149.56 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.838 0.351 . . . . 0.0 111.347 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 21.5 tptm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.028 177.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 120.945 0.402 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.405 HG21 ' CD1' ' A' ' 31' ' ' LEU . 69.4 mt -66.97 122.26 17.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.681 -174.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -105.62 135.3 47.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.395 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.465 HG21 ' HE2' ' A' ' 98' ' ' LYS . 4.3 t -125.9 130.16 50.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.271 0.558 . . . . 0.0 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -126.6 136.41 52.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.808 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 p -113.75 132.18 55.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.035 0.445 . . . . 0.0 111.391 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -119.21 126.0 27.29 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.203 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.403 ' HA ' HD12 ' A' ' 100' ' ' ILE . 72.9 Cg_endo -73.84 145.79 36.85 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.844 2.362 . . . . 0.0 111.815 176.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -64.21 151.54 84.96 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.5 2.134 . . . . 0.0 111.928 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 p -97.33 151.6 19.75 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.817 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -54.04 -43.45 70.19 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.692 0.282 . . . . 0.0 111.489 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.466 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -64.09 -46.35 84.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.125 -178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -64.66 -41.24 96.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.059 -176.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.75 -36.61 76.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.709 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 69.3 t80 -73.45 -45.39 54.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.051 0.453 . . . . 0.0 111.099 -177.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.466 HD21 ' O ' ' A' ' 14' ' ' ALA . 4.5 mm? -67.24 -48.28 68.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -74.01 -20.25 60.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.13 0.49 . . . . 0.0 110.888 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 64.44 11.03 6.21 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.917 0.865 . . . . 0.0 110.301 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 m -138.78 141.56 38.79 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.268 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.552 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -86.92 155.4 20.23 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.592 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.3 p30 -158.17 129.15 6.42 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.867 0.365 . . . . 0.0 110.738 -173.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.453 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -87.1 142.99 27.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.02 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.9 m -122.31 116.98 25.02 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.627 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.5 t -111.42 131.56 55.1 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.742 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.2 tt -121.44 128.89 52.6 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.17 0.509 . . . . 0.0 109.879 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.478 HG13 HD12 ' A' ' 31' ' ' LEU . 33.3 t -121.51 132.33 70.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.656 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -142.5 175.95 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.895 0.379 . . . . 0.0 111.235 -172.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 30' ' ' ASN . 0.9 OUTLIER 63.48 46.98 4.03 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.414 175.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.478 HD12 HG13 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -85.94 150.73 24.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.088 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.455 0 CA-C-O 121.319 0.58 . . . . 0.0 109.465 176.374 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.234 0.238 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.515 HG22 ' HA3' ' A' ' 68' ' ' GLY . 14.2 mm -121.56 137.44 55.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.6 t -146.45 144.6 29.79 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.693 0.283 . . . . 0.0 110.741 -179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.627 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 64.5 m95 -125.19 156.75 37.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.139 0.495 . . . . 0.0 111.443 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.39 155.1 29.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.505 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.3 m -80.04 157.54 26.72 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -53.51 -25.14 15.38 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.082 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.0 p -78.66 -2.15 37.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.55 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.47 22.06 48.89 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.776 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 42.6 mt-10 -99.55 123.82 46.69 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 25.1 Cg_exo -61.07 136.24 63.98 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.482 2.121 . . . . 0.0 112.097 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.402 ' HA ' HD21 ' A' ' 49' ' ' LEU . 9.1 mt -101.8 146.29 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.137 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -68.17 105.74 2.19 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 175.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 C--N 1.319 -0.724 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.524 -177.831 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.236 0.342 0 CA-C-O 121.118 0.485 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.407 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -110.3 148.78 31.26 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 18.5 ptpt -132.64 141.22 48.54 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.339 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.515 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -128.27 128.95 6.12 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.781 178.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.9 t -109.83 127.04 66.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.908 0.385 . . . . 0.0 110.285 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.592 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.13 130.28 56.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.33 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.0 p -97.37 114.55 26.38 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.288 0.566 . . . . 0.0 111.007 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.552 HG21 ' HB1' ' A' ' 22' ' ' ALA . 17.9 m -119.8 167.15 13.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.083 -176.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.4 m -74.69 146.64 42.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.6 t -58.98 -33.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.45 0.643 . . . . 0.0 109.63 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.64 -33.57 71.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.722 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -63.5 -44.23 94.92 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.362 0.601 . . . . 0.0 109.653 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.455 ' NE1' ' HD3' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -74.29 -34.13 63.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.522 179.501 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -66.99 -25.16 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -95.35 7.38 46.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.703 177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 54.49 37.79 28.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.5 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -63.97 158.46 22.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.137 0.494 . . . . 0.0 111.144 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 35.0 tt0 -109.32 139.53 44.15 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.632 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -123.07 156.83 34.11 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.095 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 98.7 t -125.54 126.04 69.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.489 -175.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.825 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.3 p -105.48 142.84 34.54 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.497 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -123.26 124.22 42.5 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.194 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.8 t -93.73 125.55 46.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 p -119.66 87.11 2.68 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.564 0.697 . . . . 0.0 111.061 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.5 ' C ' ' H ' ' A' ' 91' ' ' ASP . 10.1 t60 -98.42 -11.55 22.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.311 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.536 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 0.6 OUTLIER 71.14 -20.75 0.21 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.508 0.723 . . . . 0.0 111.28 -178.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.5 ' H ' ' C ' ' A' ' 89' ' ' HIS . 25.0 t70 -72.35 -36.29 68.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.987 0.422 . . . . 0.0 110.431 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.36 150.71 61.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.428 177.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 -20.15 15.23 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.93 2.42 . . . . 0.0 112.508 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 57.3 p -145.46 130.52 9.14 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.447 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.497 ' HB2' HG23 ' A' ' 86' ' ' THR . 15.4 Cg_endo -57.35 140.73 93.93 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.512 2.141 . . . . 0.0 111.561 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -86.9 132.91 33.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 -177.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -107.93 135.83 48.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.575 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.825 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 65.9 mmtt -126.54 135.74 51.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.885 174.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.656 ' HD1' ' CD2' ' A' ' 99' ' ' PHE . 61.5 m-85 -101.46 129.97 47.61 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.734 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 13.9 tt -128.51 138.99 53.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.668 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.5 t -154.85 149.98 26.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.455 ' HD3' ' NE1' ' A' ' 77' ' ' TRP . 22.8 tptm . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.931 -177.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.233 0 CA-C-O 121.605 0.717 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.467 HG21 HD21 ' A' ' 31' ' ' LEU . 77.8 mt -68.93 122.76 20.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.974 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.0 mt -104.44 130.14 52.36 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.492 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 2.4 t -127.93 130.31 48.26 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.197 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -128.44 146.34 50.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.005 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.4 p -112.64 135.01 53.87 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.27 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.96 122.25 31.6 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.004 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.48 141.35 50.58 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.999 2.466 . . . . 0.0 111.967 177.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.54 ' HG2' HD12 ' A' ' 16' ' ' ILE . 58.4 Cg_endo -67.87 150.19 78.35 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.605 2.203 . . . . 0.0 111.424 177.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.0 t -78.88 131.23 36.35 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.71 -177.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.653 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 61.6 t80 -58.83 -34.01 71.06 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.114 -174.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.65 76.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.337 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.86 -38.08 87.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.055 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.54 HD12 ' HG2' ' A' ' 11' ' ' PRO . 75.1 mt -62.08 -36.82 76.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.355 176.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -72.38 -44.31 62.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.568 -178.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.4 mp -71.02 -48.28 53.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.586 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.3 m -79.67 -16.18 56.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.871 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 60.7 19.85 9.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.903 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.6 m -139.87 129.94 25.0 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.515 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -90.43 154.83 19.37 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -160.13 130.31 5.42 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.859 0.361 . . . . 0.0 110.733 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.593 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -84.22 138.29 33.04 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.4 m -120.62 127.04 51.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 -178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.507 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 46.5 t -114.53 138.0 51.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.011 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -122.59 123.11 40.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.595 ' O ' ' HA ' ' A' ' 65' ' ' SER . 46.6 t -120.96 127.05 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.078 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.5 t -143.69 178.8 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.75 0.309 . . . . 0.0 111.235 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 60.02 33.58 21.36 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.314 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.467 HD21 HG21 ' A' ' 4' ' ' ILE . 56.3 mt -57.11 142.28 43.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.728 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.432 178.794 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.9 m120 . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.53 HG22 ' HA3' ' A' ' 68' ' ' GLY . 14.1 mm -121.25 136.69 57.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.5 t -138.99 153.19 48.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 73.9 m95 -134.51 146.99 50.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.383 0.611 . . . . 0.0 111.798 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.47 165.72 34.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.702 -1.136 . . . . 0.0 107.969 176.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.537 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 63.1 p -88.13 173.32 8.9 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.955 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.444 ' HB2' ' HB2' ' A' ' 82' ' ' GLU . 6.0 tp-100 -58.77 -34.97 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.401 0.62 . . . . 0.0 110.062 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.9 m -78.55 -5.7 53.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.806 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 11.71 59.38 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.225 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.537 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 7.1 pt-20 -76.38 131.75 74.22 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -64.43 138.28 59.4 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.282 1.988 . . . . 0.0 112.012 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.417 ' HA ' HD22 ' A' ' 49' ' ' LEU . 8.9 mt -120.16 136.07 54.75 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.463 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.92 107.58 7.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.233 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.9 m . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.525 -177.82 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.595 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 11.1 m . . . . . 0 N--CA 1.442 -0.867 0 CA-C-O 121.288 0.566 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.49 ' HB2' HD12 ' A' ' 39' ' ' ILE . . . -141.49 162.43 35.51 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.065 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -130.27 140.75 50.66 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.53 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -138.39 127.62 3.87 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -124.97 133.27 69.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.09 0.472 . . . . 0.0 111.065 -173.512 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.553 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.73 134.51 55.04 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.663 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -96.77 119.11 34.64 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.126 0.489 . . . . 0.0 110.327 -174.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.515 HG21 ' HB1' ' A' ' 22' ' ' ALA . 20.0 m -126.35 166.28 22.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.269 -175.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.9 t -75.02 154.65 37.93 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.2 t -61.2 -33.47 56.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.553 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 13.2 mm-40 -62.57 -30.8 71.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.748 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.67 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 6.4 m-20 -59.7 -50.99 71.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.171 0.51 . . . . 0.0 109.652 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.518 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -63.11 -37.15 86.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.007 176.862 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.553 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 90.6 m-20 -69.49 -18.89 63.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.857 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -94.27 7.06 46.71 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.12 -0.363 . . . . 0.0 111.02 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 57.78 27.36 14.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.874 0.845 . . . . 0.0 109.525 -174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.67 ' HB3' ' O ' ' A' ' 76' ' ' ASP . 1.3 tppp? -68.5 142.64 55.23 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.188 -1.369 . . . . 0.0 109.963 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.444 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 58.1 mt-10 -105.99 143.93 33.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.929 0.395 . . . . 0.0 110.074 -178.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.474 ' HA ' ' HA ' ' A' ' 43' ' ' SER . 71.3 m-85 -121.62 154.86 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.839 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.658 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 67.1 t -127.68 133.76 66.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.18 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.431 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 39.9 t -105.28 132.65 51.21 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.2 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.471 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -114.87 119.7 37.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.331 176.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.99 126.91 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.967 -178.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.27 98.48 5.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.645 0.736 . . . . 0.0 110.907 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -99.36 -10.51 22.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.161 -177.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.453 ' O ' ' HD2' ' A' ' 90' ' ' ARG . 1.6 tmm_? 69.91 7.12 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 122.122 0.963 . . . . 0.0 108.85 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.458 ' HB3' HD12 ' A' ' 4' ' ' ILE . 13.0 t70 -84.23 -33.73 24.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.287 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.73 152.56 65.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.073 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.85 -23.86 16.02 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.061 2.508 . . . . 0.0 112.961 -175.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.5 t -131.17 124.45 20.43 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 110.109 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.471 ' HB2' HG23 ' A' ' 86' ' ' THR . 27.8 Cg_endo -60.53 142.51 98.15 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 123.498 2.798 . . . . 0.0 112.848 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -81.99 141.41 33.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.908 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.468 ' HE3' HG12 ' A' ' 84' ' ' VAL . 30.6 mtpp -112.11 127.03 55.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 0.0 110.549 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.658 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 71.9 mmtt -117.64 140.05 50.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.51 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.42 ' CD1' HG23 ' A' ' 84' ' ' VAL . 72.8 m-85 -101.59 131.73 47.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.3 tt -121.94 138.14 53.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.249 0.547 . . . . 0.0 111.336 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.1 t -159.06 150.69 20.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.096 176.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.576 ' HE3' ' HB2' ' A' ' 13' ' ' PHE . 42.7 tttm . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.684 176.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 120.901 0.382 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.701 HD13 ' HB3' ' A' ' 92' ' ' LEU . 44.9 mt -59.69 121.21 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.993 0.425 . . . . 0.0 111.155 -172.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.2 mt -117.53 132.18 56.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.322 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.32 127.3 53.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.815 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -115.96 130.39 56.8 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.532 ' HB ' HD13 ' A' ' 100' ' ' ILE . 11.2 p -115.9 136.46 53.02 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.014 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.423 HD13 ' N ' ' A' ' 9' ' ' ILE . 4.1 mp -116.54 119.21 36.28 Favored Pre-proline 0 N--CA 1.442 -0.844 0 CA-C-O 121.069 0.461 . . . . 0.0 110.042 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 61.1 Cg_endo -71.59 138.98 33.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.554 2.169 . . . . 0.0 111.065 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HD2' ' CE2' ' A' ' 77' ' ' TRP . 54.6 Cg_endo -66.97 151.8 81.46 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.593 2.195 . . . . 0.0 111.711 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.48 ' O ' HG13 ' A' ' 16' ' ' ILE . 20.7 t -82.01 137.42 35.1 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.619 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 24.4 t80 -57.88 -30.48 65.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.911 -174.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.593 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -69.09 -46.07 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.565 176.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.55 -39.81 94.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.497 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.52 HD13 ' HA ' ' A' ' 13' ' ' PHE . 72.1 mt -59.48 -37.51 70.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.577 176.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 61.6 t80 -68.72 -42.39 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.361 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.2 mt -61.92 -40.15 94.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.811 -177.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.448 ' C ' ' H ' ' A' ' 21' ' ' SER . 25.9 t -88.3 -13.71 40.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.051 -179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 19' ' ' SER . 86.0 tttt 70.88 -8.47 0.95 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.711 0.767 . . . . 0.0 110.618 -174.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 19' ' ' SER . 20.0 m -132.41 144.57 50.6 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.268 -178.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.834 ' HB1' ' HB ' ' A' ' 72' ' ' VAL . . . -78.54 175.42 10.37 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.543 ' HA ' HG21 ' A' ' 72' ' ' VAL . 9.9 p30 -160.12 138.05 9.93 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -177.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.686 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 31.9 mt -105.97 125.65 51.24 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.01 -176.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.3 m -109.0 127.32 53.98 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.999 0.428 . . . . 0.0 110.54 -177.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.608 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.4 t -118.26 137.13 53.25 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.976 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.15 122.68 32.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.503 ' O ' ' HA ' ' A' ' 65' ' ' SER . 39.2 t -116.08 128.37 73.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.0 p -142.26 177.31 8.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.78 0.324 . . . . 0.0 111.365 -174.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 59.79 38.36 21.53 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.723 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.464 HD21 HG21 ' A' ' 4' ' ' ILE . 69.8 mt -66.49 131.65 46.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.759 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB1' ' OD2' ' A' ' 91' ' ' ASP . . . . . . . . 0 CA--C 1.522 -0.108 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.579 -178.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 . . . . . 0 C--O 1.234 0.247 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.547 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -121.05 136.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.1 t -135.48 135.78 40.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.721 0.296 . . . . 0.0 110.271 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.608 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 68.8 m95 -123.24 139.0 54.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.093 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.77 160.14 42.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.741 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 79.0 p -87.65 161.53 17.63 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.18 176.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.68 -21.42 66.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.059 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.4 p -76.46 -8.46 57.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.811 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.67 22.44 31.16 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.767 -0.73 . . . . 0.0 113.036 176.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -94.47 121.96 62.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.26 135.3 53.42 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.055 1.836 . . . . 0.0 110.516 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 49' ' ' LEU . 2.2 mt -108.31 139.79 42.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.367 0.604 . . . . 0.0 111.885 -171.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 3.6 tm-20 -57.22 116.51 3.32 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.386 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 -175.897 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 19.3 m . . . . . 0 N--CA 1.445 -0.723 0 CA-C-O 121.203 0.525 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -143.03 163.92 31.49 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.73 -172.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -127.89 137.99 52.51 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 176.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.547 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -147.02 131.57 4.01 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.686 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.5 p -129.42 137.93 55.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.68 0.276 . . . . 0.0 110.899 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.5 151.48 33.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.5 -177.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 26.3 m -98.0 114.16 26.21 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 122.38 1.086 . . . . 0.0 110.89 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.834 ' HB ' ' HB1' ' A' ' 22' ' ' ALA . 1.7 t -116.93 167.83 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.526 -172.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.419 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 19.0 m -100.13 139.97 35.03 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 175.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.9 p -54.32 -36.61 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-O 121.174 0.512 . . . . 0.0 110.475 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -56.41 -36.55 69.06 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.888 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.537 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 44.3 m-20 -67.26 -48.84 66.52 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.297 0.57 . . . . 0.0 109.938 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.43 ' CE2' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -69.12 -34.56 75.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.264 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -66.14 -22.03 66.36 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.241 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -102.12 10.66 39.29 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.128 177.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 80' ' ' ARG . 13.4 mmt180 58.78 36.71 24.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.306 178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.537 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 61.9 mtpt -74.26 164.25 26.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.991 0.424 . . . . 0.0 110.753 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.82 148.98 42.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.812 -176.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.643 ' HD2' ' CD1' ' A' ' 83' ' ' PHE . 93.7 m-85 -130.64 162.06 30.22 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.222 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.4 t -119.58 129.51 75.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.333 0.587 . . . . 0.0 110.953 -177.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.413 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 37.7 t -105.45 140.31 38.74 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 173.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 m -126.2 132.79 51.7 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.7 t -112.6 125.69 69.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.092 0.472 . . . . 0.0 111.08 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -107.6 85.76 2.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.616 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.511 ' HB3' HD21 ' A' ' 92' ' ' LEU . 3.5 t60 -98.8 -16.84 18.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.898 -176.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 70.89 -22.09 0.19 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.102 0.561 . . . . 0.0 111.408 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.509 ' H ' ' C ' ' A' ' 89' ' ' HIS . 14.5 t0 -72.26 -37.04 69.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.661 0.743 . . . . 0.0 110.767 -178.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.701 ' HB3' HD13 ' A' ' 4' ' ' ILE . 1.4 pt? -89.55 147.66 38.42 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.057 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -50.41 -32.91 35.75 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.506 2.137 . . . . 0.0 112.717 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.452 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 31.5 m -155.93 154.8 28.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -51.74 139.44 48.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.463 2.108 . . . . 0.0 112.062 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.8 pt20 -94.85 141.89 28.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.453 -177.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -107.73 127.59 53.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.138 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -120.23 132.89 55.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.624 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.622 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 94.7 m-85 -100.36 135.72 41.36 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -177.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.532 HD13 ' HB ' ' A' ' 8' ' ' THR . 11.9 tt -126.6 137.45 57.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.8 p -158.61 149.55 20.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.248 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.008 179.463 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 N--CA 1.451 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.466 HG21 HD21 ' A' ' 31' ' ' LEU . 64.9 mt -60.2 123.68 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.688 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 65.7 mt -111.78 131.49 55.29 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.053 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.2 t -117.42 130.58 56.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.588 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.9 135.4 51.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.335 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -113.36 132.78 55.47 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.836 0.35 . . . . 0.0 110.754 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -117.62 124.25 29.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.653 -174.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.41 139.45 49.52 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.692 2.262 . . . . 0.0 111.583 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.18 156.09 67.81 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.993 2.462 . . . . 0.0 112.741 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 16' ' ' ILE . 43.9 t -84.17 137.56 33.45 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.493 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.666 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 93.8 m-85 -61.37 -42.42 98.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.469 -175.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.96 -35.58 81.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.984 0.421 . . . . 0.0 110.444 177.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -68.02 -44.25 76.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.326 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 12' ' ' SER . 81.1 mt -59.75 -36.8 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.627 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.648 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 44.4 t80 -72.3 -44.09 63.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.517 -177.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.92 -48.07 75.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.504 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 t -75.15 -21.41 58.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttm 69.4 7.05 6.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.695 0.759 . . . . 0.0 110.309 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.5 t -138.49 142.1 39.39 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.508 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -88.8 144.38 26.27 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.549 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -130.39 120.36 24.15 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.495 0.664 . . . . 0.0 110.821 -174.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.674 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.8 mt -78.1 129.72 35.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.233 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.2 m -116.24 126.17 53.24 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.283 0.563 . . . . 0.0 111.107 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.0 t -127.17 137.0 52.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.149 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.41 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.13 137.05 48.86 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.642 177.045 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.6 HG23 ' HB1' ' A' ' 66' ' ' ALA . 11.8 m -117.65 145.3 23.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -142.36 176.43 9.0 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 58.32 48.77 11.99 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.544 0.527 . . . . 0.0 112.068 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.466 HD21 HG21 ' A' ' 4' ' ' ILE . 26.2 mt -82.11 117.03 21.96 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.439 0 CA-C-O 121.399 0.619 . . . . 0.0 110.685 178.145 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.513 -0.473 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.507 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.8 mm -120.5 136.32 57.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 176.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.4 m -128.36 126.59 41.0 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.29 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.413 ' HB2' ' OG1' ' A' ' 51' ' ' THR . 67.8 m95 -108.29 137.84 45.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.794 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.03 165.15 34.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.175 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.682 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 24.1 t -79.61 173.27 12.76 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 173.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.5 ' HA ' HG21 ' A' ' 84' ' ' VAL . 52.7 tt0 -53.3 -33.67 54.22 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.4 t -77.52 -7.74 56.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.801 0.334 . . . . 0.0 111.473 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.16 30.44 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.554 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.682 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 9.9 pt-20 -89.2 124.85 63.79 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.34 142.59 94.96 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.712 2.941 . . . . 0.0 114.489 -168.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 49' ' ' LEU . 9.3 mt -120.47 147.39 45.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.524 175.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 23.1 mm-40 -63.26 106.63 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.319 0.58 . . . . 0.0 111.059 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.413 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 18.5 m . . . . . 0 C--N 1.32 -0.708 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.915 -177.31 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.477 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 19.3 m . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.835 0.35 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.6 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -108.38 155.25 20.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 172.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -130.6 141.37 50.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.108 0.48 . . . . 0.0 110.391 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.507 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -136.56 123.09 2.79 Favored Glycine 0 N--CA 1.437 -1.288 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.674 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.7 p -125.48 131.37 72.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 120.959 0.409 . . . . 0.0 111.187 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.549 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.33 142.47 46.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.294 -177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 m -98.63 114.03 26.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.508 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.1 m -123.01 165.97 18.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.6 t -78.02 151.81 33.35 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.2 -29.26 46.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 4.3 mm-40 -66.29 -32.71 74.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.413 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -60.39 -45.4 93.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.352 0.596 . . . . 0.0 109.512 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.564 ' CD1' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -72.04 -35.0 69.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.431 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.497 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 72.1 m-20 -67.03 -32.77 74.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.373 178.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -95.34 11.67 31.84 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? 63.38 38.67 9.94 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.293 0.371 . . . . 0.0 111.986 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -66.03 154.7 38.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -119.92 139.79 51.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.211 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.635 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 78.9 m-85 -128.29 160.64 31.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.609 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 69.5 t -125.23 125.17 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.337 -178.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 33.9 t -105.76 132.28 52.07 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.554 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -121.14 134.0 55.22 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -179.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.42 125.9 72.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.846 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -123.12 105.64 10.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.193 0.521 . . . . 0.0 110.451 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -101.02 -10.53 20.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.086 -177.353 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.622 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 1.0 OUTLIER 74.1 -0.7 3.28 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 0.0 109.417 -170.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.424 ' CB ' HD12 ' A' ' 4' ' ' ILE . 24.0 t0 -72.56 -36.62 68.27 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.156 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.19 154.23 58.47 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.372 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -75.16 -21.86 15.14 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.956 2.437 . . . . 0.0 112.779 -177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.1 m -130.1 119.58 18.84 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.106 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.554 ' HB2' HG23 ' A' ' 86' ' ' THR . 50.6 Cg_endo -69.1 143.24 53.32 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.866 2.377 . . . . 0.0 112.725 -177.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -81.2 142.0 33.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.562 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 19.7 ptpt -116.53 143.08 46.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.023 0.439 . . . . 0.0 111.059 179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 48.1 mmtt -122.01 140.83 52.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.608 178.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -101.14 146.33 27.61 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 tt -144.9 137.72 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.007 -0.677 . . . . 0.0 112.43 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 p -159.21 142.9 14.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.564 ' HD3' ' CD1' ' A' ' 77' ' ' TRP . 20.8 pttp . . . . . 0 C--O 1.247 0.953 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.444 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 CA--C 1.516 -0.356 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.504 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.3 mt -60.2 121.78 8.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.636 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.15 131.02 51.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.115 0.484 . . . . 0.0 111.413 -176.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -121.59 119.45 31.94 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.648 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.663 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 79.7 m-85 -116.29 132.27 56.71 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.6 p -112.45 131.02 55.78 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.234 0.54 . . . . 0.0 110.701 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.9 mm -117.74 123.96 29.26 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.785 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.524 ' HA ' HD12 ' A' ' 100' ' ' ILE . 43.5 Cg_endo -67.33 139.22 49.1 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.203 1.935 . . . . 0.0 110.391 173.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.525 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 56.5 Cg_endo -63.77 132.38 34.78 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.053 1.836 . . . . 0.0 110.658 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.476 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 15.4 t -78.5 145.39 34.97 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.852 -176.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -59.57 -29.39 67.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.323 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.42 ' O ' HD11 ' A' ' 18' ' ' LEU . . . -65.53 -46.45 79.54 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 174.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.476 ' OD2' ' HB3' ' A' ' 12' ' ' SER . 31.0 m-20 -64.96 -43.6 92.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.607 -179.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.5 mt -58.32 -34.65 50.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.581 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.654 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 59.1 t80 -72.14 -42.39 66.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.879 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 14' ' ' ALA . 6.9 mp -59.9 -48.84 80.06 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.198 -176.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 p -94.6 -10.61 31.46 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 64.54 18.83 11.57 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.3 0.571 . . . . 0.0 110.884 -178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.6 t -139.02 144.94 39.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.116 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.42 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -87.16 134.93 33.47 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.659 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 39.1 m-80 -137.0 116.82 13.1 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.151 -174.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -73.34 146.01 45.55 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.86 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.5 m -125.27 124.89 42.63 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.683 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.675 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 38.1 t -117.23 134.27 54.99 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.932 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -114.76 123.54 49.5 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.93 128.64 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.821 0.343 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.6 m -144.02 172.29 13.08 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.822 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 60.27 52.19 5.05 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.893 0.746 . . . . 0.0 112.473 171.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.504 ' HA ' HG12 ' A' ' 4' ' ' ILE . 30.9 mt -75.87 153.43 36.78 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.16 177.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.53 0.205 . . . . 0.0 111.236 -177.511 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.512 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -120.06 135.14 61.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.8 m -124.72 135.01 52.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.828 0.347 . . . . 0.0 110.832 -178.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 85' ' ' CYS . 66.2 m95 -125.83 138.01 53.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.104 174.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.74 158.19 41.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.669 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 t -78.54 160.56 27.57 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -55.54 -32.0 62.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.089 0.471 . . . . 0.0 111.086 -179.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.03 -4.77 43.13 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.425 -178.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.04 22.97 28.71 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.394 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -92.37 122.12 65.17 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -64.78 144.09 82.43 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.772 2.315 . . . . 0.0 112.786 -177.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 mt -120.4 146.39 46.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.41 0.624 . . . . 0.0 111.783 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.33 118.2 11.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.936 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.404 HG22 ' HD1' ' A' ' 41' ' ' TRP . 1.8 m . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.096 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.1 p . . . . . 0 N--CA 1.464 0.258 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.21 143.37 32.72 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.478 0.656 . . . . 0.0 111.974 -163.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.675 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 97.8 mttt -130.18 139.09 50.88 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.919 177.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.512 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -119.94 115.52 3.01 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.211 176.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -108.2 120.74 60.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.849 0.357 . . . . 0.0 110.209 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.659 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.97 132.45 56.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.905 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.0 m -98.0 118.95 35.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.191 0.52 . . . . 0.0 110.829 -174.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.42 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.4 m -124.43 167.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.152 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.6 t -78.21 149.34 33.69 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -65.48 -27.28 41.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.802 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.12 -35.66 81.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.943 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -65.02 -42.23 94.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.522 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -73.8 -36.52 65.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.431 179.214 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 -73.16 -21.15 60.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.913 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -94.96 7.08 47.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.953 0.406 . . . . 0.0 110.209 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.5 ttp180 54.75 39.43 31.36 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.195 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -65.1 164.78 12.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.339 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -108.73 139.2 43.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.616 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.522 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 68.3 m-85 -124.77 148.9 47.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.723 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.1 t -117.6 127.17 75.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.842 -174.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.438 ' HB2' ' CH2' ' A' ' 41' ' ' TRP . 43.8 t -105.44 136.68 44.56 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.499 HG21 ' HG2' ' A' ' 97' ' ' LYS . 1.0 OUTLIER -125.93 130.0 50.42 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 178.465 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.75 124.08 54.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.523 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.28 92.48 3.7 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.74 0.781 . . . . 0.0 110.395 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -97.9 -9.22 26.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.294 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.33 17.66 11.07 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.542 -174.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -82.99 -27.89 30.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.001 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.52 153.87 77.97 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.177 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.23 -22.78 12.43 Favored 'Trans proline' 0 N--CA 1.465 -0.185 0 C-N-CA 123.076 2.517 . . . . 0.0 112.329 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 10.6 p -113.82 105.69 54.35 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.432 177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.482 ' HB2' HG23 ' A' ' 86' ' ' THR . 30.9 Cg_endo -64.14 141.49 76.47 Favored 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.573 2.182 . . . . 0.0 111.738 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -83.73 128.0 34.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.396 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.499 ' HG2' HG21 ' A' ' 86' ' ' THR . 49.7 mtmt -106.88 139.33 41.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.385 0.612 . . . . 0.0 111.074 178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 42.2 mmtt -118.15 130.71 56.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.686 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.608 ' HE2' ' CE1' ' A' ' 99' ' ' PHE . 93.6 m-85 -101.45 121.87 42.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.947 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 ' HA ' ' A' ' 10' ' ' PRO . 14.0 tt -123.79 139.22 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.114 0.483 . . . . 0.0 110.656 -178.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.1 t -158.1 150.65 22.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.218 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.799 179.229 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 . . . . . 0 CA--C 1.515 -0.401 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.518 HG12 ' HA ' ' A' ' 31' ' ' LEU . 76.1 mt -61.37 126.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.2 mt -104.69 129.74 52.83 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.228 0.537 . . . . 0.0 110.022 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.555 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.2 t -125.24 127.86 47.4 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.72 -179.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -123.91 142.06 51.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' THR . . . . . 0.414 ' HB ' HD13 ' A' ' 100' ' ' ILE . 16.8 p -113.6 135.0 54.39 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.523 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.14 121.9 31.87 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.1 138.89 34.52 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.665 2.243 . . . . 0.0 111.682 177.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.416 ' HG2' HD12 ' A' ' 16' ' ' ILE . 58.5 Cg_endo -68.62 146.88 68.71 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.467 2.111 . . . . 0.0 111.523 178.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 m -83.14 142.6 31.11 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.118 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.658 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 69.8 t80 -54.02 -43.77 70.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -172.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.648 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.88 -40.64 95.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.945 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.21 -39.38 93.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.09 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.416 HD12 ' HG2' ' A' ' 11' ' ' PRO . 71.6 mt -64.55 -32.89 59.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.602 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.66 ' HE2' ' CE1' ' A' ' 17' ' ' PHE . 26.0 t80 -71.59 -37.05 71.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.327 -177.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 24.2 mt -67.41 -42.68 82.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.852 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.8 p -85.94 -21.28 27.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.427 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.9 mmtp 66.97 6.19 4.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.213 -175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.2 p -138.62 125.62 21.25 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.505 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -70.34 138.26 51.28 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.6 p30 -117.27 128.4 55.03 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.229 0.538 . . . . 0.0 110.227 -177.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.692 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 77.7 mt -91.22 122.63 34.01 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.635 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 56.5 m -111.19 123.82 50.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.266 0.555 . . . . 0.0 111.081 -176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.1 t -117.89 137.21 52.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.559 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -121.56 123.58 42.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.549 HG12 HG12 ' A' ' 87' ' ' VAL . 22.5 t -117.25 120.6 65.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 p -136.08 176.56 8.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.005 -173.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 12.7 m120 56.98 50.6 11.89 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.763 0.664 . . . . 0.0 111.769 175.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.518 ' HA ' HG12 ' A' ' 4' ' ' ILE . 39.0 mt -74.5 128.91 36.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.683 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.292 -176.575 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 . . . . . 0 N--CA 1.448 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.494 HG23 HG22 ' A' ' 51' ' ' THR . 3.0 mp -120.76 135.34 61.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 174.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.3 m -129.6 122.86 29.94 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.658 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.606 ' HD1' HG21 ' A' ' 51' ' ' THR . 79.7 m95 -106.11 136.94 44.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.165 0.507 . . . . 0.0 110.829 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.56 141.0 18.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.87 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 44.6 t -70.57 151.3 45.18 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 175.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -64.57 -21.25 66.65 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.693 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 -4.72 41.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.108 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.68 23.16 26.66 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.852 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 23.7 mt-10 -95.46 120.77 63.2 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 11.8 Cg_exo -70.63 141.99 43.0 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.238 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 49' ' ' LEU . 9.5 mt -126.53 141.5 51.85 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.103 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -80.67 107.25 13.32 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.356 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.606 HG21 ' HD1' ' A' ' 41' ' ' TRP . 9.6 m . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.489 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.455 ' HB2' HD12 ' A' ' 39' ' ' ILE . . . -115.15 160.56 19.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.936 174.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -130.46 140.93 50.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -141.01 124.11 2.48 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.692 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.4 p -119.0 135.98 57.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-O 121.011 0.434 . . . . 0.0 111.354 -174.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.478 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.9 147.87 40.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.708 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.8 m -99.44 114.34 27.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.839 0.352 . . . . 0.0 110.195 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.505 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 1.8 m -122.34 166.88 16.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.17 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.5 m -86.02 145.52 27.05 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.06 -33.57 53.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 CA-C-O 121.676 0.751 . . . . 0.0 109.517 -178.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 75' ' ' GLU . 1.8 mp0 -57.1 -37.44 71.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.893 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -62.34 -42.37 99.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.724 0.773 . . . . 0.0 109.015 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.54 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -69.87 -41.01 75.37 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.347 178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -71.96 -21.79 61.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.481 -178.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -97.53 9.12 43.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.58 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 58.51 36.86 25.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.643 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -71.34 162.8 28.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.81 0.338 . . . . 0.0 110.8 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.652 ' HA ' ' HG ' ' A' ' 101' ' ' SER . 56.4 mp0 -106.98 137.8 44.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.188 0.518 . . . . 0.0 110.575 -177.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.54 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 76.1 m-85 -125.31 146.34 49.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.692 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 99.5 t -121.17 129.02 76.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.808 -176.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.747 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.2 p -107.11 123.28 48.0 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.524 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -112.17 131.1 55.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.107 -178.812 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.549 HG12 HG12 ' A' ' 28' ' ' VAL . 40.2 t -105.46 127.33 60.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.989 -176.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.8 p -120.46 90.6 3.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.515 0.674 . . . . 0.0 110.669 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.539 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 11.3 t60 -99.44 -10.17 22.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.658 -175.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.511 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 8.2 tpt180 74.04 0.68 3.68 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.158 0.98 . . . . 0.0 109.853 -174.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.539 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.76 -36.4 65.09 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.286 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.34 154.84 80.71 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.701 -177.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.17 -31.37 12.07 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.929 2.419 . . . . 0.0 112.434 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 21.0 m -112.63 109.17 53.46 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.642 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.524 ' HB2' HG23 ' A' ' 86' ' ' THR . 17.8 Cg_endo -59.68 140.27 92.75 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.569 2.179 . . . . 0.0 111.789 -178.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.2 143.49 31.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.452 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -128.59 144.07 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.439 -177.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.747 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 69.6 mmtt -126.28 146.59 49.95 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.197 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.26 129.69 55.5 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.414 HD13 ' HB ' ' A' ' 8' ' ' THR . 15.0 tt -131.31 138.73 52.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.84 0.352 . . . . 0.0 110.57 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.652 ' HG ' ' HA ' ' A' ' 82' ' ' GLU . 50.3 m -157.14 150.41 23.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.776 -177.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.423 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 22.2 tptm . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.661 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 120.661 0.267 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.627 HG21 HD21 ' A' ' 31' ' ' LEU . 93.8 mt -84.3 125.63 40.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 174.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . 0.457 HD21 ' HB2' ' A' ' 30' ' ' ASN . 1.5 mm? -100.81 130.52 46.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.183 0.516 . . . . 0.0 110.245 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.512 HG22 HG12 ' A' ' 87' ' ' VAL . 23.4 p -117.88 135.45 54.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.025 -178.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.633 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 89.4 m-85 -133.43 143.54 48.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.519 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 p -113.84 136.97 52.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.199 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.425 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 38.6 mm -117.27 125.03 28.5 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.885 0.374 . . . . 0.0 110.699 -176.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.43 140.15 21.4 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.075 2.517 . . . . 0.0 112.212 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.78 152.11 74.13 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.949 2.432 . . . . 0.0 112.249 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.44 ' HB3' ' OD1' ' A' ' 15' ' ' ASP . 47.9 t -90.98 151.68 20.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.308 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.558 ' HE1' ' HE3' ' A' ' 102' ' ' LYS . 58.2 m-85 -60.93 -31.86 71.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.242 -174.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.5 75.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.507 ' HA ' HD11 ' A' ' 18' ' ' LEU . 9.3 m-20 -74.48 -24.96 59.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.363 0.602 . . . . 0.0 110.72 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 12' ' ' SER . 69.8 mt -74.48 -25.27 19.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.651 0.739 . . . . 0.0 109.384 172.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.647 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 11.3 t80 -73.7 -47.62 38.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.355 -175.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.795 HD12 ' H ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -77.94 -36.36 49.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.362 0.601 . . . . 0.0 111.547 -169.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.795 ' H ' HD12 ' A' ' 18' ' ' LEU . 24.1 t -89.85 -8.45 51.95 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.988 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.3 mttm 59.07 16.32 4.67 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.015 -178.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.1 m -139.77 152.81 46.89 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.509 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -94.09 122.61 36.78 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.463 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 19.9 m120 -106.28 128.35 53.91 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.429 0.633 . . . . 0.0 111.071 -174.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.57 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 85.9 mt -84.29 138.01 33.15 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.886 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.425 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 89.7 m -124.92 117.63 24.49 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.38 0.61 . . . . 0.0 110.497 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.554 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.6 t -109.93 131.99 54.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.417 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.1 tt -126.24 130.67 51.37 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.171 0.51 . . . . 0.0 110.54 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.46 HG13 HD22 ' A' ' 31' ' ' LEU . 44.9 t -122.36 125.28 72.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.754 -178.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.53 ' HB3' ' OG ' ' A' ' 65' ' ' SER . 14.5 p -138.91 176.26 8.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.226 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . 0.457 ' HB2' HD21 ' A' ' 5' ' ' LEU . 3.8 m-20 59.05 46.7 13.0 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.644 0.59 . . . . 0.0 111.041 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.656 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 15.8 mt -79.74 160.23 26.3 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.99 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.446 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 176.059 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.523 HG22 ' HA3' ' A' ' 68' ' ' GLY . 20.2 mm -119.74 135.82 58.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -132.06 135.16 46.28 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.732 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.554 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 56.9 m95 -116.74 138.6 51.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.024 0.44 . . . . 0.0 110.818 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -150.23 162.29 40.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.322 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.488 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 36.6 t -74.82 168.07 20.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -63.67 -24.35 67.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.928 0.394 . . . . 0.0 111.391 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.7 m -83.55 3.38 32.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.408 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.48 22.13 54.7 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.861 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 36.3 mt-10 -87.46 121.78 70.98 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -178.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.38 142.67 88.42 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 123.326 2.684 . . . . 0.0 113.28 -175.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mt -123.17 146.8 47.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.713 178.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.63 108.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.96 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.439 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 8.5 m . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.145 -177.145 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.53 ' OG ' ' HB3' ' A' ' 29' ' ' SER . 8.2 m . . . . . 0 N--CA 1.45 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 112.073 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.527 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.12 150.03 28.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.369 175.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 20.4 ttmm -131.58 139.31 49.16 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -132.92 128.76 5.23 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.61 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.57 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.6 t -114.43 125.01 71.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.728 0.299 . . . . 0.0 111.24 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.463 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -118.44 146.76 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.068 175.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.4 m -100.33 122.29 42.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.825 0.345 . . . . 0.0 110.662 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 22' ' ' ALA . 1.5 m -122.42 167.24 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.36 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -71.76 143.01 49.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.85 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -61.8 -35.25 66.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.818 0.818 . . . . 0.0 108.85 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.89 -32.35 74.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.787 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.02 -47.62 83.93 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.578 ' HH2' HG12 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -67.87 -42.83 80.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.754 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.64 -28.0 68.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.534 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -89.43 7.39 36.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.602 0.239 . . . . 0.0 110.739 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 64.81 37.32 7.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.007 176.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.41 ' HB3' ' HE3' ' A' ' 81' ' ' LYS . 26.7 mmmt -72.44 160.01 33.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.185 178.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -124.06 138.82 54.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.806 -177.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.641 ' HD2' ' CD1' ' A' ' 83' ' ' PHE . 90.9 m-85 -122.73 160.98 24.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.705 -178.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.1 t -124.62 128.89 73.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.056 0.455 . . . . 0.0 110.854 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.728 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 26.4 p -106.5 142.98 35.27 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.02 176.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.424 HG21 ' HG2' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -122.48 121.59 36.93 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.255 0.55 . . . . 0.0 110.999 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.512 HG12 HG22 ' A' ' 6' ' ' THR . 0.5 OUTLIER -104.27 134.96 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.353 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.8 92.92 3.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.307 0.575 . . . . 0.0 110.425 -173.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.656 ' CE1' ' HB3' ' A' ' 31' ' ' LEU . 3.2 t-160 -99.03 -10.98 21.92 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.25 9.78 2.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.773 0.797 . . . . 0.0 110.092 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.479 ' HB3' HD12 ' A' ' 4' ' ' ILE . 43.9 t0 -101.7 -23.67 14.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.959 -173.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.481 HD23 ' HG3' ' A' ' 96' ' ' GLN . 0.4 OUTLIER -108.55 160.33 27.58 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.058 179.718 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.13 -32.51 94.72 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.115 1.877 . . . . 0.0 112.826 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.406 ' O ' HD11 ' A' ' 92' ' ' LEU . 23.1 t -153.68 141.7 13.91 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -177.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.92 140.8 47.84 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.011 2.474 . . . . 0.0 111.571 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.481 ' HG3' HD23 ' A' ' 92' ' ' LEU . 41.8 mt-30 -89.68 130.02 36.02 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.805 -175.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 52.3 mtmt -101.9 126.82 48.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.374 176.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.728 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -123.3 141.94 51.46 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.94 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -99.7 142.79 30.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.899 -176.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.578 HG12 ' HH2' ' A' ' 77' ' ' TRP . 13.6 tt -134.87 137.56 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.9 t -157.97 149.84 21.84 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.108 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HE3' ' HE1' ' A' ' 13' ' ' PHE . 76.4 tttt . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.495 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 121.598 0.713 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.623 HG21 HD21 ' A' ' 31' ' ' LEU . 76.2 mt -64.64 122.93 16.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.051 176.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.1 mt -109.48 130.58 55.49 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.93 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.9 t -111.4 133.48 53.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.325 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.67 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 68.3 m-85 -125.21 142.27 51.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.725 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.2 p -115.6 136.81 52.7 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.909 0.385 . . . . 0.0 111.129 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . 0.482 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -118.71 125.98 27.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.022 178.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -78.94 139.57 15.46 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.786 2.324 . . . . 0.0 111.622 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -69.96 149.77 66.05 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.573 2.182 . . . . 0.0 111.81 178.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.47 ' O ' HG13 ' A' ' 16' ' ' ILE . 21.8 m -88.26 137.3 32.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.403 -177.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 1.603 ' HE1' ' CE2' ' A' ' 13' ' ' PHE . 75.6 t80 -54.18 -37.39 64.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.772 -1.103 . . . . 0.0 112.996 -169.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.38 -46.56 69.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.82 0.343 . . . . 0.0 110.653 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.95 -38.93 93.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.664 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 13' ' ' PHE . 89.1 mt -58.26 -39.85 75.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.798 176.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -69.41 -44.6 71.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.805 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 18' ' ' LEU . 4.4 mm? -69.87 -44.6 69.47 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.331 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.488 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -70.8 -7.66 46.87 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.884 -178.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 72.48 -18.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.549 0.739 . . . . 0.0 111.517 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 19' ' ' SER . 57.4 m -138.72 162.35 34.9 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 176.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.559 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -99.19 159.32 15.07 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -128.08 134.54 49.17 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.237 0.542 . . . . 0.0 110.384 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.56 ' HB2' ' HB2' ' A' ' 70' ' ' ALA . 70.8 mt -88.35 126.04 35.0 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' THR . . . . . 0.482 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 62.7 m -111.0 112.32 24.06 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.413 0.625 . . . . 0.0 111.065 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 37.7 t -111.77 129.12 56.23 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.322 176.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -124.1 123.35 40.13 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.554 HG12 HG12 ' A' ' 87' ' ' VAL . 12.0 t -118.15 119.95 62.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.426 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.2 t -135.04 178.2 7.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.33 -174.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.8 41.86 20.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.345 0.593 . . . . 0.0 110.764 -176.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.623 HD21 HG21 ' A' ' 4' ' ' ILE . 43.4 mt -70.38 126.14 28.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.745 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.352 -175.716 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.1 t30 . . . . . 0 N--CA 1.451 -0.425 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.514 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.0 mm -121.08 140.29 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -142.19 135.68 29.18 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 122.019 -0.426 . . . . 0.0 111.456 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.52 ' HD1' HG22 ' A' ' 51' ' ' THR . 67.6 m95 -119.21 149.88 41.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.888 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.45 144.67 18.46 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.192 175.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -65.09 163.17 15.4 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.351 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -53.43 -31.6 46.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.228 0.537 . . . . 0.0 110.941 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.8 t -72.87 -0.68 14.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.075 -178.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.51 17.77 67.82 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.57 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 52.5 mt-10 -93.99 127.86 43.52 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -176.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.7 Cg_exo -57.97 136.32 74.36 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 123.036 2.491 . . . . 0.0 112.911 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.572 HD13 ' HB3' ' A' ' 70' ' ' ALA . 0.3 OUTLIER -97.69 146.84 24.94 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.915 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 6.8 tp10 -67.31 104.67 1.55 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.52 HG22 ' HD1' ' A' ' 41' ' ' TRP . 1.7 m . . . . . 0 C--N 1.311 -1.072 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.287 -177.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.8 p . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.84 148.2 28.82 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.92 171.085 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.472 ' HE2' HG21 ' A' ' 25' ' ' THR . 63.5 tttm -132.31 139.23 48.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -175.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.514 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -128.97 133.98 7.81 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.782 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 45.7 t -114.49 124.21 70.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.572 ' HB3' HD13 ' A' ' 49' ' ' LEU . . . -114.85 155.98 25.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.4 179.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 m -108.41 121.35 44.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.673 0.273 . . . . 0.0 110.998 -172.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.559 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 4.2 m -128.34 153.35 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.211 0.529 . . . . 0.0 110.115 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 m -77.5 145.93 36.71 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.994 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.9 t -58.03 -33.57 46.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.463 0.649 . . . . 0.0 109.663 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -57.63 -42.34 83.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.222 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -67.58 -41.35 84.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CD1' ' HG2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -68.98 -35.14 76.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.185 179.468 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -69.62 -26.28 64.36 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.052 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -91.51 7.1 42.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.028 0.442 . . . . 0.0 110.004 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 60.02 39.13 20.27 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.582 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.551 ' HE2' ' HA ' ' A' ' 81' ' ' LYS . 3.2 mmpt? -56.67 147.45 22.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.962 174.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -115.0 139.33 49.94 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.882 178.042 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.667 ' HE2' ' CE1' ' A' ' 83' ' ' PHE . 94.4 m-85 -125.5 158.09 35.36 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.524 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 76.6 t -123.06 125.52 72.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.575 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.8 p -105.76 135.44 47.17 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.2 OUTLIER -125.31 136.29 53.33 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.554 HG12 HG12 ' A' ' 28' ' ' VAL . 28.8 t -110.57 127.72 67.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.829 0.347 . . . . 0.0 111.154 -175.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 p -114.85 90.17 3.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.418 0.628 . . . . 0.0 111.409 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -98.66 -15.41 19.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.667 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 64.12 24.02 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.486 -178.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -98.91 -36.51 9.74 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.51 0.671 . . . . 0.0 109.462 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.468 HD11 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -100.08 148.03 34.29 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.808 172.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.53 -22.48 38.45 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.269 2.646 . . . . 0.0 112.884 -172.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.468 ' O ' HD11 ' A' ' 92' ' ' LEU . 14.3 m -132.88 130.07 21.4 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 24.5 Cg_exo -62.56 141.0 84.59 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.464 2.109 . . . . 0.0 112.139 -178.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.452 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.4 pt20 -87.99 142.01 28.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.395 -178.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 20.1 ptmt -127.17 148.47 50.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.225 0.536 . . . . 0.0 111.209 -175.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.653 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 61.6 mmtt -134.15 145.6 49.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.611 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 1.619 ' HE1' ' CE2' ' A' ' 99' ' ' PHE . 34.3 m-85 -105.7 142.69 35.01 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 9.7 tt -142.38 138.12 29.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.766 0.317 . . . . 0.0 111.191 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 p -158.34 148.66 20.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.679 ' HG2' ' CD1' ' A' ' 77' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.822 -0.609 . . . . 0.0 110.022 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 CA--C 1.517 -0.299 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.589 HG12 ' HA ' ' A' ' 31' ' ' LEU . 64.5 mt -59.61 121.65 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -103.98 131.05 51.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.515 -176.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.472 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 11.6 p -117.5 122.17 42.97 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.427 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -133.92 145.41 49.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.034 0.445 . . . . 0.0 110.406 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.8 p -115.41 135.91 53.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.317 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.15 121.82 31.96 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.547 ' HA ' HD12 ' A' ' 100' ' ' ILE . 59.4 Cg_endo -70.44 140.01 39.15 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.751 2.301 . . . . 0.0 111.654 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.458 ' HG2' HD12 ' A' ' 16' ' ' ILE . 66.1 Cg_endo -68.88 144.96 60.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.26 1.973 . . . . 0.0 110.806 176.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -79.2 138.15 37.72 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -54.05 -42.59 69.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.72 0.295 . . . . 0.0 111.287 -170.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.655 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.4 -38.25 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.339 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -66.27 -35.9 81.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.059 0.457 . . . . 0.0 110.349 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.458 HD12 ' HG2' ' A' ' 11' ' ' PRO . 53.7 mt -67.36 -32.04 55.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.01 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.617 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 29.8 t80 -66.49 -36.94 83.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.652 177.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.0 mt -76.82 -48.01 19.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.006 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.7 m -80.53 -10.35 59.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.408 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 63.2 mmtt 71.05 -57.09 0.61 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.557 0.743 . . . . 0.0 111.739 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 20.0 m -95.08 127.17 40.93 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 176.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.545 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -60.97 145.53 50.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.777 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -120.62 124.53 45.48 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.302 0.572 . . . . 0.0 110.558 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.58 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 83.5 mt -83.36 130.52 35.06 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.807 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 m -115.26 122.76 46.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.183 0.516 . . . . 0.0 111.139 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.405 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.9 t -111.27 138.47 47.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.723 -178.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -126.19 122.45 35.67 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 t -127.86 120.83 54.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 t -137.43 177.08 8.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.5 -173.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.6 35.8 24.74 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.116 0.566 . . . . 0.0 112.048 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.592 HD23 ' HD2' ' A' ' 89' ' ' HIS . 48.9 mt -60.07 124.95 21.82 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.2 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -170.316 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.6 m120 . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.527 HG22 ' HA3' ' A' ' 68' ' ' GLY . 22.3 mm -120.43 135.82 59.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 m -139.27 125.84 20.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.077 0.465 . . . . 0.0 111.531 -176.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.533 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 85.8 m95 -106.81 148.2 28.79 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.122 174.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.0 156.13 36.83 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' SER . . . . . 0.733 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 22.8 m -87.84 156.8 19.21 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -60.24 -19.98 56.9 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -72.76 -7.35 50.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.211 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.8 18.24 41.44 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.041 176.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 13.2 pt-20 -101.81 133.9 20.48 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 120.507 0.194 . . . . 0.0 110.745 -177.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 12.1 Cg_exo -69.78 136.79 33.81 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.676 2.251 . . . . 0.0 112.416 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 mt -106.08 142.02 36.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.62 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -64.57 106.72 1.21 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.938 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 12.2 m . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.804 178.83 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.5 p . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.659 0.742 . . . . 0.0 112.885 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.71 148.34 30.61 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.112 167.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -131.48 140.64 49.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.527 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -136.69 127.49 4.11 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.608 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.58 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 43.3 t -115.08 128.29 72.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.759 0.314 . . . . 0.0 110.596 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.496 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -116.53 148.64 40.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.69 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 m -99.93 124.1 44.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.266 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.545 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.6 m -119.73 166.96 13.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.456 ' HB3' ' OD2' ' A' ' 76' ' ' ASP . 23.2 t -86.68 154.29 21.1 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.193 -178.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.37 -39.66 85.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.076 0.465 . . . . 0.0 110.67 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -58.36 -36.24 73.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.789 -178.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.456 ' OD2' ' HB3' ' A' ' 73' ' ' SER . 13.3 m-20 -63.94 -45.02 91.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.335 0.588 . . . . 0.0 110.094 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.432 ' HE1' ' HD2' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.5 -35.07 68.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.196 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -65.76 -30.22 70.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.235 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -90.85 7.27 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.096 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 57.89 36.77 26.6 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.387 0.43 . . . . 0.0 110.912 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -68.93 163.31 24.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.336 -177.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -114.69 139.75 49.41 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.507 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 99' ' ' PHE . 75.1 m-85 -121.14 157.29 30.47 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.792 177.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 93.5 t -120.75 129.0 76.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 0.0 110.967 -176.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.533 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 34.9 t -106.18 127.62 53.34 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.12 126.16 52.38 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.1 t -105.9 125.67 61.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.143 0.497 . . . . 0.0 111.1 -177.147 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.1 p -120.56 103.9 9.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.723 ' ND1' ' HB2' ' A' ' 91' ' ' ASP . 39.6 t-80 -98.39 -20.37 17.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.048 -176.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.517 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 18.9 ttt180 74.04 8.13 4.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.008 0.908 . . . . 0.0 108.786 -169.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.723 ' HB2' ' ND1' ' A' ' 89' ' ' HIS . 11.2 t0 -93.58 -36.41 12.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.773 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -119.32 151.96 51.88 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.319 178.501 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.58 -31.33 11.05 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 123.017 2.478 . . . . 0.0 112.801 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.3 m -116.77 111.54 41.17 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.168 -176.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.91 141.25 83.63 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.257 1.971 . . . . 0.0 111.939 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -86.43 127.4 34.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -112.76 128.31 56.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.305 178.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 64.5 mmtt -122.77 149.32 44.27 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.023 -174.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.4 m-85 -105.73 146.79 29.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.966 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' A' ' 10' ' ' PRO . 13.8 tt -136.34 138.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.265 175.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.7 t -158.85 149.92 20.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.523 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.821 ' HA ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.558 -0.735 . . . . 0.0 110.321 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 . . . . . 0 C--O 1.234 0.25 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.549 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.1 mt -70.7 123.12 24.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.264 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.1 mt -104.95 131.03 52.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.009 0.433 . . . . 0.0 110.345 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.406 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 13.9 p -109.42 123.48 49.42 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.843 -179.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -119.32 131.39 55.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.2 p -119.51 131.57 55.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.369 176.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.88 124.48 28.75 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.975 0.417 . . . . 0.0 110.495 -178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.41 140.73 24.69 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.886 2.391 . . . . 0.0 111.507 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.538 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 51.8 Cg_endo -64.85 147.41 89.44 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.578 2.185 . . . . 0.0 111.845 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.41 ' O ' HG13 ' A' ' 16' ' ' ILE . 10.7 p -89.56 146.44 24.58 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.136 -177.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . 0.807 ' HE1' ' HE2' ' A' ' 102' ' ' LYS . 47.9 m-85 -59.76 -31.39 69.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.446 -174.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.15 76.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.563 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.02 -35.07 66.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.502 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 12' ' ' SER . 83.1 mt -63.46 -32.02 55.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.461 176.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . 1.668 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 79.6 t80 -62.99 -43.93 97.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.405 177.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.98 -47.87 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.422 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 21' ' ' SER . 44.6 m -70.69 -24.24 62.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.972 -177.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt 70.94 -6.07 1.36 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.496 0.718 . . . . 0.0 111.368 -177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 19' ' ' SER . 71.3 p -137.9 161.99 35.2 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.73 32.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -125.88 130.26 50.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.986 0.422 . . . . 0.0 110.057 -177.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 88.6 mt -86.29 128.91 34.99 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.45 -176.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.2 m -109.05 114.4 28.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.504 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.593 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 25.3 t -114.05 134.82 54.61 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.117 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -135.97 129.11 31.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.142 0.496 . . . . 0.0 110.109 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.451 HG12 HG12 ' A' ' 87' ' ' VAL . 15.4 t -123.35 132.87 70.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' SER . . . . . 0.409 ' CB ' ' HG ' ' A' ' 65' ' ' SER . 8.9 t -143.3 171.84 13.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.156 0.503 . . . . 0.0 111.557 -173.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 64.51 48.95 2.53 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.173 169.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.549 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -72.79 157.17 38.0 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.098 -1.41 . . . . 0.0 109.122 178.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 120.881 0.372 . . . . 0.0 110.926 -179.81 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.523 HG22 ' HA3' ' A' ' 68' ' ' GLY . 17.5 mm -121.14 136.05 59.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 t -145.67 128.58 16.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.896 0.379 . . . . 0.0 110.863 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.593 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 55.2 m95 -108.7 149.03 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.474 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.55 163.81 38.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.622 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 t -84.68 168.69 15.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -57.37 -29.18 63.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.086 0.47 . . . . 0.0 110.85 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -73.66 -4.3 33.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.526 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.1 20.79 54.52 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.812 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.8 mt-10 -99.64 123.6 47.29 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 32.2 Cg_exo -58.66 137.55 80.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.154 2.569 . . . . 0.0 113.217 -173.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -106.34 148.35 28.14 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.664 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.51 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 39.4 mm-40 -62.71 106.59 0.82 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.808 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' THR . . . . . 0.496 HG21 ' HD1' ' A' ' 41' ' ' TRP . 3.1 m . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.874 -177.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.409 ' HG ' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.312 0 CA-C-O 121.669 0.747 . . . . 0.0 112.859 . . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.474 ' HB1' HD12 ' A' ' 39' ' ' ILE . . . -109.54 158.51 17.94 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.287 175.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -134.23 140.43 46.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.747 0.308 . . . . 0.0 110.462 -176.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -139.43 138.69 9.45 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -123.2 129.0 75.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.802 0.334 . . . . 0.0 110.78 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.51 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.61 150.49 37.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.406 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.4 m -102.63 119.85 39.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.8 m -127.19 166.4 23.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.977 0.418 . . . . 0.0 110.779 -176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.563 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.8 m -85.16 137.62 32.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.271 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -65.67 -24.98 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.436 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.2 -33.95 76.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.034 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . 0.563 ' OD1' ' HB2' ' A' ' 73' ' ' SER . 3.5 m-20 -66.11 -41.32 90.71 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.538 ' CZ2' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -65.86 -41.33 91.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.072 177.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.28 -30.07 69.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.995 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -91.38 8.01 38.28 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.214 -0.195 . . . . 0.0 111.061 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.97 37.26 21.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.467 -178.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -67.2 161.83 23.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.05 0.453 . . . . 0.0 110.146 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -112.65 140.53 47.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.445 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.415 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.9 m-85 -121.32 149.69 42.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.482 176.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 90.2 t -123.01 120.33 60.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.083 -173.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.641 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.7 p -105.67 135.32 47.3 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.2 m -122.38 132.94 54.62 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.775 0.322 . . . . 0.0 110.156 -177.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.451 HG12 HG12 ' A' ' 28' ' ' VAL . 44.3 t -109.1 126.99 66.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.766 -178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -117.8 88.5 2.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.59 0.709 . . . . 0.0 111.58 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.538 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 23.5 t60 -98.82 -6.89 28.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.514 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 0.1 OUTLIER 52.29 24.09 2.7 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.901 -175.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -94.05 -28.51 15.69 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.562 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.481 HD11 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -118.23 156.07 51.01 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.049 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.52 -21.86 39.4 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.056 2.504 . . . . 0.0 113.106 -175.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.481 ' O ' HD11 ' A' ' 92' ' ' LEU . 37.5 p -134.63 125.0 17.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.499 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.423 ' HB2' HG23 ' A' ' 86' ' ' THR . 18.0 Cg_endo -61.35 141.38 92.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.585 2.19 . . . . 0.0 111.412 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' ' 86' ' ' THR . 33.2 mt-30 -80.58 126.73 31.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.964 0.411 . . . . 0.0 111.148 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -107.36 126.71 52.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.368 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.641 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 16.7 mmtt -115.27 133.78 55.73 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.967 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.21 122.75 44.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.799 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.5 tt -122.17 139.89 47.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.159 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -157.28 150.01 23.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.047 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.807 ' HE2' ' HE1' ' A' ' 13' ' ' PHE . 47.7 tttm . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.813 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.593 HG21 HD21 ' A' ' 31' ' ' LEU . 73.5 mt -60.4 121.49 8.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.228 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.31 138.32 43.72 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.257 -176.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 28' ' ' VAL . 2.2 p -115.05 120.07 38.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.858 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PHE . . . . . 1.63 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 97.6 m-85 -119.36 132.01 55.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 178.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 p -115.63 132.48 56.62 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.258 176.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.96 125.92 27.64 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.81 0.338 . . . . 0.0 110.427 -177.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HA ' HD12 ' A' ' 100' ' ' ILE . 55.9 Cg_endo -70.75 139.59 37.1 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.612 2.208 . . . . 0.0 111.444 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.506 ' HG2' HD12 ' A' ' 16' ' ' ILE . 55.7 Cg_endo -68.81 154.96 70.18 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.736 2.29 . . . . 0.0 112.447 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.442 ' O ' HG13 ' A' ' 16' ' ' ILE . 11.9 p -84.82 126.09 33.15 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 -177.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -61.4 -30.83 70.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.554 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -62.18 -40.28 95.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 177.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.04 -43.14 58.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.903 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.506 HD12 ' HG2' ' A' ' 11' ' ' PRO . 76.5 mt -57.69 -32.69 43.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.469 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.08 -39.0 93.41 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.43 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 41.1 mt -72.6 -48.14 42.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.557 -173.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.8 p -86.46 -18.16 32.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.865 0.364 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm 68.87 16.12 8.87 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.734 0.813 . . . . 0.0 110.117 -174.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -135.35 128.88 32.53 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.314 -176.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.426 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -87.14 136.61 32.86 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.613 176.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 48.8 m-80 -122.93 125.9 46.21 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.147 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 70.9 mt -83.46 131.08 35.04 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.003 -178.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.2 m -119.07 121.19 39.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.286 0.565 . . . . 0.0 110.949 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' CYS . . . . . 0.561 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.4 t -126.88 137.97 53.24 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.171 178.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 3.9 tt -133.5 132.9 41.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.009 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.581 HG22 HG22 ' A' ' 87' ' ' VAL . 43.6 t -115.12 118.52 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.864 -178.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.9 p -121.2 178.57 4.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.869 -169.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 59.17 35.88 23.76 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.464 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.593 HD21 HG21 ' A' ' 4' ' ' ILE . 9.7 mt -71.79 123.64 23.08 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.307 0 CA-C-O 121.143 0.496 . . . . 0.0 110.922 -178.96 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t30 . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ILE . . . . . 0.49 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.2 mm -120.08 134.41 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 m -129.32 133.84 47.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.041 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' TRP . . . . . 0.561 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 79.6 m95 -111.77 146.59 37.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.23 174.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.07 164.39 38.1 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.927 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.4 t -73.8 167.17 21.96 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.452 ' HA ' HG21 ' A' ' 84' ' ' VAL . 35.9 tt0 -59.78 -31.22 69.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.008 0.432 . . . . 0.0 110.841 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.4 m -75.11 -6.81 51.52 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.435 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.35 19.69 37.77 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.295 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 6.6 mm-40 -81.77 122.42 80.25 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 23.3 Cg_exo -62.38 135.8 55.85 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.546 2.164 . . . . 0.0 113.352 -172.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.4 HD21 ' HA ' ' A' ' 49' ' ' LEU . 7.6 mt -105.91 148.36 27.71 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.217 177.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.65 106.33 2.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.419 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.824 -178.759 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.529 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 5.5 m . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.071 0.463 . . . . 0.0 111.622 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . 0.406 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.49 160.96 15.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.785 177.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.3 ttmt -130.59 139.11 50.41 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLY . . . . . 0.49 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -126.36 119.65 3.47 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.471 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 46.6 t -108.48 123.98 64.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.808 0.337 . . . . 0.0 110.818 -177.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . 0.471 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.98 137.15 52.37 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.081 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.7 m -98.99 116.09 30.44 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.238 0.542 . . . . 0.0 110.144 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' VAL . . . . . 0.426 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 2.3 m -120.34 166.82 14.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.692 -177.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 m -75.95 134.19 40.27 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.584 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.6 p -53.02 -34.07 20.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -56.83 -40.81 76.71 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.456 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -67.24 -44.67 78.84 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.473 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -63.5 -42.01 98.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.824 176.643 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ASN . . . . . 0.584 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 7.5 t30 -73.11 -11.71 60.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.988 -176.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -107.18 12.61 28.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 65.74 37.85 5.53 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.783 176.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -76.84 152.72 35.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.115 0.483 . . . . 0.0 111.545 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.53 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 42.6 mt-10 -109.35 138.82 45.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.252 177.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 70.2 m-85 -125.37 151.92 45.47 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.02 176.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 88.2 t -116.54 129.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.38 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' CYS . . . . . 0.659 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 43.3 t -105.89 131.87 52.69 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' THR . . . . . 0.526 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -125.99 137.34 53.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . 0.581 HG22 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -128.29 133.46 66.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.197 0.522 . . . . 0.0 112.139 -173.169 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -114.93 100.44 8.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.681 -177.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' HIS . . . . . 0.479 ' C ' ' H ' ' A' ' 91' ' ' ASP . 18.5 t60 -99.79 -11.03 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.696 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 50.0 ttt180 74.06 -24.05 0.21 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.045 0.538 . . . . 0.0 111.116 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 89' ' ' HIS . 39.0 t70 -71.97 -31.88 66.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.158 0.504 . . . . 0.0 110.46 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.78 152.22 42.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.747 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.29 -21.87 10.09 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.192 2.595 . . . . 0.0 113.249 -176.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' SER . . . . . 0.448 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 57.4 p -125.76 114.95 24.71 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.453 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' PRO . . . . . 0.526 ' HB2' HG23 ' A' ' 86' ' ' THR . 16.3 Cg_endo -58.25 141.87 97.02 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 111.228 176.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLN . . . . . 0.507 ' O ' ' HA ' ' A' ' 86' ' ' THR . 44.4 mt-30 -91.19 128.47 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.761 -173.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . 0.659 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.6 ptmt -111.52 130.19 55.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.211 0.529 . . . . 0.0 110.827 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 68.1 mmtt -121.56 152.91 38.71 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.733 -177.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.5 130.48 55.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' ILE . . . . . 0.495 HD12 ' HA ' ' A' ' 10' ' ' PRO . 16.0 tt -126.84 144.12 38.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' SER . . . . . 0.53 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 29.5 t -156.77 151.0 25.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.503 -175.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' LYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 13.8 tmtt? . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.725 -0.655 . . . . 0.0 110.078 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.8 mtt . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.39 18.07 79.19 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.845 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -154.5 120.84 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.523 HG21 HD21 ' A' ' 31' ' ' LEU . 67.7 mt -75.67 122.2 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.119 0.485 . . . . 0.0 111.883 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.441 HD21 ' HE1' ' A' ' 7' ' ' PHE . 11.1 mp -103.97 131.57 51.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.276 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.445 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 6.7 t -124.42 127.64 47.84 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.521 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.635 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 93.5 m-85 -138.0 148.7 45.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.52 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.7 p -112.35 141.57 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.738 0.304 . . . . 0.0 110.714 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.3 mm -117.15 122.74 30.82 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 121.114 0.483 . . . . 0.0 110.361 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.25 143.59 17.69 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.013 2.475 . . . . 0.0 111.754 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.68 141.84 38.58 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 121.988 1.792 . . . . 0.0 110.328 175.151 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.414 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.9 m -80.05 156.22 27.2 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.36 -174.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.669 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 84.4 t80 -53.99 -42.91 69.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.779 0.323 . . . . 0.0 110.266 179.621 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.688 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -61.68 -45.7 92.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.191 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -62.28 -44.47 96.45 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.972 0.415 . . . . 0.0 110.776 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 12' ' ' SER . 54.8 mt -65.52 -29.44 47.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.54 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.667 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 29.3 t80 -71.49 -39.71 70.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.315 -179.241 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.688 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 20.7 mt -67.0 -48.41 68.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.093 -176.324 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -89.52 -23.11 22.12 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.163 -175.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 64.04 19.22 11.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.963 -175.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.4 m -137.74 134.24 35.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.895 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.38 141.36 30.05 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 10.0 p30 -127.27 137.41 52.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.149 0.499 . . . . 0.0 109.899 -176.265 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.451 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 84.6 mt -95.86 126.52 41.18 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.687 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 m -120.05 132.47 55.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.835 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.462 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 39.7 t -123.1 137.39 54.93 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.73 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -117.55 123.19 45.64 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.469 HG12 HG12 ' A' ' 87' ' ' VAL . 22.7 t -122.56 119.63 58.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.036 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.2 t -137.15 178.75 6.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.611 -172.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 61.08 30.19 19.33 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.691 0.619 . . . . 0.0 111.742 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.646 HD12 HD23 ' A' ' 37' ' ' LEU . 44.3 mt -62.15 126.31 26.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -26.84 68.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.336 0.589 . . . . 0.0 110.154 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p -127.77 94.95 4.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.285 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -77.43 63.93 2.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.3 0.571 . . . . 0.0 111.287 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.41 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 6.9 tt0 -99.76 -80.92 0.47 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.018 177.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.7 p -132.97 161.48 34.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.664 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.646 HD23 HD12 ' A' ' 31' ' ' LEU . 63.9 tp -156.15 147.48 22.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.069 0.461 . . . . 0.0 110.996 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -127.45 152.75 47.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.715 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.477 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.8 mm -120.95 137.13 55.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 25.4 m -130.12 130.03 44.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.764 0.316 . . . . 0.0 111.226 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.53 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 70.9 m95 -117.31 141.91 47.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.523 175.592 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.38 156.3 40.43 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.631 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.445 ' HA ' ' HD2' ' A' ' 83' ' ' PHE . 19.6 m -74.98 158.84 32.59 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -54.08 -30.85 49.9 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.047 0.451 . . . . 0.0 111.277 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -73.4 -1.56 18.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.96 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.84 21.37 47.02 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.073 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -99.95 122.04 52.07 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 34.6 Cg_exo -58.67 137.9 82.72 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.859 2.373 . . . . 0.0 112.385 -176.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.441 HD21 ' HA ' ' A' ' 49' ' ' LEU . 10.9 mt -103.51 146.55 28.36 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.99 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.79 105.87 0.5 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.227 175.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.9 m -120.83 136.58 54.88 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.658 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -119.41 123.0 43.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.414 0.626 . . . . 0.0 110.478 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.426 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 54.1 mt -133.67 127.89 53.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.713 -1.13 . . . . 0.0 109.972 -175.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.491 ' HG3' HG21 ' A' ' 55' ' ' VAL . 20.6 tptm -97.09 122.87 40.57 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.914 177.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.688 HG13 ' H ' ' A' ' 57' ' ' GLU . 41.5 t 80.16 123.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.967 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -81.0 10.93 4.45 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.712 0.768 . . . . 0.0 110.819 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.688 ' H ' HG13 ' A' ' 55' ' ' VAL . 36.8 tt0 -122.52 154.07 38.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.571 -178.014 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 p -75.75 145.98 40.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.441 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 16.3 m170 -91.78 127.59 49.42 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -171.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.441 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 97.7 Cg_endo -103.87 22.46 0.13 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.762 2.975 . . . . 0.0 113.006 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -112.99 115.84 29.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.103 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.6 -53.96 4.32 Favored Glycine 0 CA--C 1.517 0.178 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.669 -176.225 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.5 m -123.29 168.71 12.13 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -115.75 24.47 11.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.371 0.605 . . . . 0.0 110.127 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 m -119.5 170.92 8.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.644 -172.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.44 ' HB2' HD21 ' A' ' 37' ' ' LEU . . . -110.52 151.65 27.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.476 171.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.462 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.4 mtmt -131.63 140.49 49.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.078 0.466 . . . . 0.0 110.153 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.477 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -117.19 125.92 6.73 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 174.362 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.451 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 54.2 t -108.63 120.84 60.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.818 0.342 . . . . 0.0 110.426 -178.228 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.431 ' HB1' ' HB2' ' A' ' 24' ' ' LEU . . . -114.46 140.17 48.93 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.895 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.3 m -99.39 115.03 28.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.152 0.501 . . . . 0.0 110.445 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -119.69 166.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.053 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.412 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 21.6 m -82.11 137.26 35.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.96 -28.54 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.917 177.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -56.99 -42.2 79.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.621 176.622 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.412 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 46.1 m-20 -63.08 -47.85 81.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 109.904 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -63.56 -39.0 93.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.328 177.766 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -69.45 -28.65 66.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.76 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -94.48 12.64 26.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 64.7 36.87 7.92 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.283 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.81 163.74 26.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.038 0.447 . . . . 0.0 110.539 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -130.71 139.34 50.29 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.595 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.654 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 83.9 m-85 -121.52 162.04 21.24 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.215 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 75.0 t -122.94 126.54 73.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.99 0.424 . . . . 0.0 111.073 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.53 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 48.5 t -106.4 136.89 45.36 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 173.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.453 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -124.36 129.57 50.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.767 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.469 HG12 HG12 ' A' ' 28' ' ' VAL . 38.9 t -102.27 126.63 56.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.668 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.1 p -117.43 93.58 4.22 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.473 0.654 . . . . 0.0 110.673 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.514 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 74.8 t60 -99.46 -7.13 26.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.181 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.467 ' HG2' ' O ' ' A' ' 89' ' ' HIS . 37.6 ptt85 65.08 -11.79 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.476 1.51 . . . . 0.0 112.537 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.514 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 16.0 t70 -76.27 -33.95 59.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.467 0.651 . . . . 0.0 110.304 -174.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.89 153.68 37.73 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.564 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.23 -23.63 11.67 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.083 2.522 . . . . 0.0 112.55 -178.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 15.9 m -132.02 114.78 15.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.917 -179.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.453 ' HB2' HG23 ' A' ' 86' ' ' THR . 14.3 Cg_endo -56.84 141.15 92.88 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.933 2.422 . . . . 0.0 111.913 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -89.65 127.1 35.87 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.458 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.502 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.9 ptpt -108.22 140.76 40.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.359 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.445 ' HE3' ' O ' ' A' ' 6' ' ' THR . 62.3 mmtt -127.37 139.97 52.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.978 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -101.67 136.99 40.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.709 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 tt -131.38 138.87 52.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.866 0.365 . . . . 0.0 110.956 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.6 t -154.53 149.99 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.581 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.408 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 53.4 tttm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.452 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.747 0.308 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.25 60.55 0.41 Allowed Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -113.64 120.27 40.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.529 HG12 ' HA ' ' A' ' 31' ' ' LEU . 54.4 mt -60.28 126.93 18.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.36 130.92 52.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.164 0.507 . . . . 0.0 110.673 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -112.56 119.46 38.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.066 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.669 ' HD1' ' CD2' ' A' ' 7' ' ' PHE . 58.1 m-85 -119.77 135.37 54.87 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.722 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 16.4 p -113.67 132.43 55.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.818 0.342 . . . . 0.0 110.533 177.495 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.64 124.79 28.58 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.189 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.31 140.44 58.5 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.775 2.317 . . . . 0.0 111.518 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.411 ' HB2' HD12 ' A' ' 16' ' ' ILE . 18.2 Cg_endo -59.05 162.03 14.59 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.271 2.647 . . . . 0.0 113.071 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.508 ' O ' HG13 ' A' ' 16' ' ' ILE . 40.7 t -78.73 114.24 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.351 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.529 ' HA ' HD13 ' A' ' 16' ' ' ILE . 32.7 t80 -56.7 -35.32 68.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.568 -171.421 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -44.76 70.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.992 0.425 . . . . 0.0 111.049 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.56 -33.67 76.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.03 -176.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.8 mt -57.85 -40.19 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.909 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -72.36 -39.33 68.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.465 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.14 -48.01 59.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.448 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.7 m -78.26 -12.82 60.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.969 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp 66.24 7.88 5.18 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.046 -176.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.9 m -138.41 134.69 34.43 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.993 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.663 ' HB1' HG13 ' A' ' 72' ' ' VAL . . . -80.57 165.4 22.13 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.688 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.435 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 25.2 m120 -139.76 151.79 46.08 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.721 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 80.9 mt -114.01 119.69 38.05 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.211 -177.139 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.7 m -105.02 123.42 47.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.311 0.577 . . . . 0.0 111.312 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 42.2 t -109.83 137.06 48.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.267 179.09 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.547 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 1.3 tm? -127.5 122.55 33.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.039 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.14 120.95 54.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.744 0.306 . . . . 0.0 110.561 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 t -137.93 178.09 7.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.448 -175.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 59.14 42.01 19.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.564 0.54 . . . . 0.0 112.182 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.529 ' HA ' HG12 ' A' ' 4' ' ' ILE . 16.3 mt -71.9 124.06 24.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 175.554 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.408 ' HB1' ' OD2' ' A' ' 91' ' ' ASP . . . -62.18 -43.43 98.85 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.41 -178.538 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.474 HG23 ' OD2' ' A' ' 91' ' ' ASP . 3.4 t -110.5 110.43 21.16 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 169.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.64 ' HD1' ' CD2' ' A' ' 34' ' ' TYR . 9.1 p90 -85.99 110.29 19.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.478 0.656 . . . . 0.0 111.07 -175.887 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -140.48 -151.92 0.39 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.98 -178.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.3 m -72.86 144.63 47.37 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.744 HD21 ' HB1' ' A' ' 66' ' ' ALA . 57.0 tp -130.18 150.39 51.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.052 0.453 . . . . 0.0 110.951 -178.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -111.07 147.2 35.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.644 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.516 HG22 ' HA3' ' A' ' 68' ' ' GLY . 30.4 mm -119.79 137.31 54.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 176.664 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.454 ' HB3' ' O ' ' A' ' 86' ' ' THR . 22.6 t -143.28 138.75 29.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.045 -0.662 . . . . 0.0 111.457 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.503 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 86.3 m95 -126.22 143.23 51.22 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.605 177.014 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.39 160.4 43.46 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.462 ' HB2' ' OE1' ' A' ' 47' ' ' GLU . 18.7 m -87.59 160.13 18.3 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -54.36 -37.32 64.81 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.417 ' HB3' ' OE1' ' A' ' 47' ' ' GLU . 10.6 t -85.59 6.61 26.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.016 0.436 . . . . 0.0 110.995 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.93 23.59 24.96 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.547 173.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.462 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 3.2 mp0 -84.51 122.12 75.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.234 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.6 136.73 64.69 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.419 2.079 . . . . 0.0 111.72 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -113.68 139.78 48.78 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.645 -176.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.55 106.66 2.23 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.895 177.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.547 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 8.9 m -115.31 114.07 24.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.931 -176.892 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -100.86 119.81 39.22 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.574 -178.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.521 HG23 HG23 ' A' ' 55' ' ' VAL . 7.4 mt -135.5 137.97 48.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.88 -169.87 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.471 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 7.3 ptpp? -131.12 106.03 8.09 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.769 0.795 . . . . 0.0 110.078 164.002 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.521 HG23 HG23 ' A' ' 53' ' ' ILE . 3.4 m -146.28 95.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.219 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -73.4 -22.03 60.35 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.226 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -155.92 155.03 32.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.771 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -78.05 135.23 37.71 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -95.28 126.5 45.91 Favored Pre-proline 0 C--N 1.32 -0.71 0 C-N-CA 119.941 -0.703 . . . . 0.0 111.865 -168.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -104.54 0.43 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.71 2.94 . . . . 0.0 111.278 162.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -128.96 130.99 47.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.532 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.17 -53.27 3.05 Favored Glycine 0 CA--C 1.518 0.236 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.2 m -122.98 164.14 19.1 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.665 ' HE1' ' CE2' ' A' ' 64' ' ' PHE . 93.8 m-85 -120.84 23.87 10.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 117.892 0.315 . . . . 0.0 110.978 -177.616 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 p -161.83 174.35 13.29 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -169.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.744 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -106.74 145.27 32.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.184 167.981 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -131.21 138.25 49.29 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.98 0.419 . . . . 0.0 110.072 -176.087 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.516 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -146.89 136.72 6.3 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 176.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.721 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 5.6 m -116.95 149.94 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 117.319 0.559 . . . . 0.0 111.342 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.547 ' HA ' ' HA ' ' A' ' 51' ' ' THR . . . -114.59 150.39 35.09 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.427 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -98.33 114.73 27.15 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 122.105 0.955 . . . . 0.0 110.063 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.663 HG13 ' HB1' ' A' ' 22' ' ' ALA . 2.1 t -119.41 153.36 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.628 0 CA-C-N 113.401 -1.727 . . . . 0.0 109.383 -173.513 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -83.98 141.1 31.46 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.473 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.5 p -53.16 -33.13 19.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-O 121.057 0.456 . . . . 0.0 109.901 176.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -55.62 -36.64 67.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.423 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -68.15 -51.91 40.62 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.122 0.487 . . . . 0.0 109.974 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD1' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -66.73 -34.96 79.0 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.515 -177.982 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.473 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 32.3 t30 -71.73 -22.16 61.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.71 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -101.33 8.88 42.14 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.829 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 64.99 37.91 6.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.25 151.1 13.21 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.48 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -109.06 138.11 45.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.448 172.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.642 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 74.1 m-85 -127.6 156.05 42.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.162 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.535 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.5 t -119.17 127.37 75.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.608 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 49.9 t -105.47 130.94 53.44 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.519 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -125.54 122.41 36.45 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.552 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.0 t -108.55 127.37 65.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.769 0.319 . . . . 0.0 111.004 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.451 HG23 ' HB3' ' A' ' 95' ' ' PRO . 23.3 p -122.16 108.82 13.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.102 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.48 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 84.9 t60 -98.43 -50.99 4.11 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.977 -176.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 37.6 ttt-85 128.55 -20.5 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 O-C-N 125.178 1.549 . . . . 0.0 107.735 -163.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.48 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.32 -37.32 66.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.314 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.15 152.14 75.45 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.281 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.32 -23.33 13.38 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.433 2.755 . . . . 0.0 112.86 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.7 m -125.59 109.93 25.78 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.481 -178.104 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.519 ' HB2' HG23 ' A' ' 86' ' ' THR . 14.1 Cg_endo -56.8 142.11 92.31 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 123.026 2.484 . . . . 0.0 112.528 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.456 ' O ' ' HA ' ' A' ' 86' ' ' THR . 41.3 mt-30 -80.94 131.37 35.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.161 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -109.46 127.89 54.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.303 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.535 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 57.6 mmtt -122.64 133.74 54.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -178.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.41 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.0 m-85 -100.91 132.71 46.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.7 tt -126.63 139.02 52.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.099 0.476 . . . . 0.0 111.255 -178.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.1 p -158.02 149.45 21.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.613 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.874 178.672 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.509 ' HA ' ' HB2' ' A' ' 32' ' ' ALA . 56.7 mtt . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.088 0.47 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.81 170.32 18.38 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -177.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . 0.467 ' O ' ' HB3' ' A' ' 30' ' ' ASN . 33.1 t70 -94.11 110.64 22.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 117.3 0.55 . . . . 0.0 110.426 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 66.2 mt -63.13 124.38 17.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.933 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.76 130.81 49.85 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.222 0.534 . . . . 0.0 109.877 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.458 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.7 m -114.66 118.29 33.25 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.005 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.69 142.68 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.176 0.513 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -119.29 131.61 55.78 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.122 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.466 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 37.1 mm -117.88 124.97 28.34 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.302 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_endo -64.35 143.64 83.47 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 122.738 2.292 . . . . 0.0 111.798 175.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.579 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 44.8 Cg_endo -65.77 152.12 82.49 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.674 2.249 . . . . 0.0 111.825 178.031 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.477 ' O ' HG13 ' A' ' 16' ' ' ILE . 34.3 t -78.23 124.29 27.91 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.645 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.629 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 89.9 m-85 -61.36 -29.55 69.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.409 179.537 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.39 77.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.216 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.9 -45.83 76.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.19 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.534 HG12 ' HA ' ' A' ' 22' ' ' ALA . 73.2 mt -56.99 -33.09 41.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 121.147 0.499 . . . . 0.0 110.693 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -66.46 -43.77 84.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -76.98 -49.38 15.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.543 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 m -74.14 -19.51 60.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.915 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt 67.44 7.11 5.33 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.249 0.619 . . . . 0.0 111.198 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.7 t -139.17 153.56 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.501 -0.772 . . . . 0.0 108.952 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.534 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -93.67 142.67 27.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.582 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 42.5 m-80 -131.19 112.42 12.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.12 0.486 . . . . 0.0 110.458 -173.731 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.549 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.7 mt -78.74 143.36 36.25 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.941 -177.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.466 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 28.0 m -125.59 123.0 38.08 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.336 0.588 . . . . 0.0 110.758 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.447 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 36.6 t -114.15 131.96 56.25 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.445 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.527 HD21 ' HE3' ' A' ' 67' ' ' LYS . 3.2 tm? -118.91 124.67 47.65 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -177.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.547 ' O ' ' HB3' ' A' ' 65' ' ' SER . 14.5 t -120.18 119.74 60.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.5 t -134.04 177.63 7.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.673 -173.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.467 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 1.1 t30 58.5 45.93 15.72 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.558 0.536 . . . . 0.0 111.447 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.638 HD11 ' HE1' ' A' ' 89' ' ' HIS . 17.7 mt -71.48 146.36 48.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.209 -175.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.509 ' HB2' ' HA ' ' A' ' 1' ' ' MET . . . -86.45 -48.92 7.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.502 -171.206 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.4 p -92.42 -102.89 0.12 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.25 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.649 ' HE2' ' CE1' ' A' ' 34' ' ' TYR . 75.4 m-85 -109.55 -170.87 1.73 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.505 -175.07 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' HG3' ' HG3' ' A' ' 57' ' ' GLU . 3.4 pm0 -86.48 5.34 35.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.605 0.24 . . . . 0.0 111.48 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.4 m -64.31 103.82 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.814 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.807 ' HG ' ' HD1' ' A' ' 89' ' ' HIS . 1.0 OUTLIER -144.3 151.34 39.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.164 0.507 . . . . 0.0 110.49 -177.071 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.462 ' H ' HD22 ' A' ' 37' ' ' LEU . 6.0 m120 -140.07 149.89 43.68 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.014 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.521 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.0 mm -120.19 136.83 55.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.4 t -137.3 131.59 32.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.97 0.414 . . . . 0.0 110.382 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.489 ' HD1' HG22 ' A' ' 51' ' ' THR . 62.3 m95 -112.8 149.91 32.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.27 163.71 39.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.178 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.715 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 31.9 t -88.13 171.84 9.95 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.835 175.529 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -55.48 -29.94 59.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.137 0.494 . . . . 0.0 111.367 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -73.53 -8.62 56.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.922 0.392 . . . . 0.0 111.108 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.66 16.08 55.52 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.456 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.715 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 12.5 pt-20 -94.31 126.97 46.27 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -174.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.26 135.46 62.0 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.012 2.475 . . . . 0.0 113.565 -172.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.482 HD12 ' CD1' ' A' ' 83' ' ' PHE . 9.8 mt -97.37 147.8 23.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.02 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.69 106.51 3.55 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.886 0.851 . . . . 0.0 110.177 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.557 HG23 HD12 ' A' ' 53' ' ' ILE . 16.5 m -143.89 114.13 7.41 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.908 -1.496 . . . . 0.0 109.382 -175.664 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.0 tttp -109.17 116.64 32.31 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 118.751 -1.179 . . . . 0.0 111.512 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.557 HD12 HG23 ' A' ' 51' ' ' THR . 0.6 OUTLIER -137.2 119.23 19.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 167.706 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.542 ' O ' HG11 ' A' ' 55' ' ' VAL . 49.2 tptt -110.9 103.55 12.06 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.678 177.171 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.542 HG11 ' O ' ' A' ' 54' ' ' LYS . 0.5 OUTLIER -170.91 151.79 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 124.296 0.997 . . . . 0.0 110.567 -177.854 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.1 mtt -107.8 9.75 28.87 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 166.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.54 ' H ' ' HB ' ' A' ' 55' ' ' VAL . 42.7 tt0 -137.52 145.87 43.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.268 -1.333 . . . . 0.0 110.265 -167.018 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.6 m -78.64 154.3 30.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -94.43 127.88 42.45 Favored Pre-proline 0 CA--C 1.516 -0.342 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.223 -173.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.427 ' HA ' ' O ' ' A' ' 63' ' ' THR . 93.0 Cg_endo -94.76 42.11 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.322 2.681 . . . . 0.0 112.772 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -101.35 96.3 7.08 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.45 -41.28 2.48 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.951 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.427 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -123.22 165.23 17.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.294 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.669 ' HD2' ' CD1' ' A' ' 64' ' ' PHE . 24.5 p90 -100.78 23.16 10.93 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.781 0.801 . . . . 0.0 109.351 176.188 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.547 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 14.6 m -112.15 173.89 6.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.566 -168.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.446 ' HB1' HD11 ' A' ' 37' ' ' LEU . . . -106.99 143.16 35.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.527 ' HE3' HD21 ' A' ' 27' ' ' LEU . 56.7 mttp -129.74 139.92 51.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.521 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -124.88 123.97 5.22 Favored Glycine 0 N--CA 1.44 -1.075 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.549 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 62.0 t -106.93 123.33 61.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.979 0.418 . . . . 0.0 109.971 -177.663 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.582 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -113.46 136.12 53.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.063 -177.433 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 p -98.16 113.54 25.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.493 -177.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.525 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.0 m -119.47 164.44 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.155 -175.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.477 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 42.5 m -74.99 140.67 43.79 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.451 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -61.54 -32.22 52.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.551 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.418 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 5.5 mm-40 -60.22 -33.94 72.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.229 177.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.477 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 4.7 m-20 -62.16 -44.81 95.78 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.445 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -74.31 -34.85 63.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.435 -179.733 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.418 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 82.7 m-20 -64.29 -32.54 74.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.756 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -92.56 6.65 46.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.928 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 58.33 38.25 25.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -66.05 166.09 12.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.406 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.407 ' HG3' ' HB2' ' A' ' 101' ' ' SER . 26.6 tt0 -123.27 139.19 54.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.084 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.482 ' CD1' HD12 ' A' ' 49' ' ' LEU . 79.2 m-85 -121.81 163.75 18.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.341 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.459 HG23 ' CD1' ' A' ' 99' ' ' PHE . 89.3 t -128.42 128.08 67.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.474 -176.912 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.723 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 25.9 p -105.89 142.81 34.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.52 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -123.53 127.31 48.15 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.765 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.493 HG12 HG12 ' A' ' 28' ' ' VAL . 60.3 t -106.47 127.26 61.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.079 -177.21 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -126.84 102.28 6.96 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.318 0.58 . . . . 0.0 109.493 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.807 ' HD1' ' HG ' ' A' ' 37' ' ' LEU . 40.9 t60 -98.52 -9.99 24.16 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.04 -174.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 71.07 11.43 6.95 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.831 0.824 . . . . 0.0 109.042 -174.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.768 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 7.0 t70 -92.66 -37.25 12.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.5 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.415 HD11 ' O ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -122.63 155.57 62.71 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.733 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.43 -31.79 10.87 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.811 2.341 . . . . 0.0 112.551 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.415 ' O ' HD11 ' A' ' 92' ' ' LEU . 22.2 p -113.04 110.25 51.57 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.63 -177.198 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.52 ' HB2' HG23 ' A' ' 86' ' ' THR . 27.5 Cg_endo -62.64 141.79 87.15 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.765 2.31 . . . . 0.0 111.892 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.15 136.16 34.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.45 -176.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -107.22 132.61 52.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.212 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.723 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -124.95 140.86 52.54 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.725 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.647 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 70.3 m-85 -104.83 141.08 37.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.142 -177.934 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.4 tt -140.5 137.32 36.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.805 0.336 . . . . 0.0 110.602 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.407 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 22.8 t -157.89 150.33 22.46 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.445 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 1.1 tmmt? . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.336 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.532 ' O ' ' HA ' ' A' ' 32' ' ' ALA . 49.1 ttm . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.495 ' HA2' ' HB3' ' A' ' 32' ' ' ALA . . . -112.27 -158.92 14.36 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.719 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 63.17 86.24 0.12 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 110.939 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.547 HG21 HD21 ' A' ' 31' ' ' LEU . 81.9 mt -60.32 122.29 10.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.792 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.6 mt -107.63 132.2 53.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.145 0.497 . . . . 0.0 110.877 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.499 HG23 HG22 ' A' ' 87' ' ' VAL . 33.4 p -107.66 127.11 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.268 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.658 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 93.0 m-85 -124.73 152.8 43.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.709 -179.514 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.0 p -134.12 138.29 45.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.574 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.413 HD13 ' N ' ' A' ' 9' ' ' ILE . 4.1 mp -117.9 123.06 29.93 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.606 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.524 ' HA ' HD12 ' A' ' 100' ' ' ILE . 72.1 Cg_endo -75.32 140.15 24.27 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.129 2.552 . . . . 0.0 111.819 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.86 150.56 61.69 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.289 1.993 . . . . 0.0 111.754 178.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -78.73 144.7 34.99 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.114 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.647 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 67.3 t80 -62.39 -31.33 71.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.089 -179.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.03 93.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.312 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.68 -47.24 84.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.974 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 57.6 mt -63.35 -34.14 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.497 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -73.28 -45.69 54.23 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.758 -175.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.0 -49.37 37.59 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.669 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.8 m -80.38 -15.83 55.91 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.158 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.8 mttp 62.16 19.6 11.04 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.299 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.7 m -141.09 154.72 46.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.372 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.747 ' HB1' HG13 ' A' ' 72' ' ' VAL . . . -104.53 162.39 13.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -146.84 145.91 30.03 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 69.4 mt -107.17 128.01 54.02 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.233 -177.134 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.7 m -115.54 126.8 54.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.163 0.506 . . . . 0.0 111.098 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.662 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 32.7 t -126.62 138.45 53.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.488 HD13 ' HG2' ' A' ' 67' ' ' LYS . 2.5 tt -132.34 135.82 46.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.235 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.456 ' O ' ' HB3' ' A' ' 65' ' ' SER . 42.1 t -118.18 125.59 74.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.372 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.4 m -127.94 176.38 7.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.295 -176.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 59.66 41.34 18.79 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.101 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.547 HD21 HG21 ' A' ' 4' ' ' ILE . 34.7 mt -80.49 126.85 31.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.549 177.39 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.532 ' HA ' ' O ' ' A' ' 1' ' ' MET . . . -66.98 -28.05 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.634 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 66.6 p -138.38 170.21 16.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.458 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.616 ' HD2' ' CD1' ' A' ' 34' ' ' TYR . 2.2 p90 -137.16 57.37 1.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.205 0.526 . . . . 0.0 111.831 -177.283 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.2 mp0 -75.31 -59.13 2.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 171.031 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.7 t -169.14 147.57 3.84 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.083 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.641 HD11 ' N ' ' A' ' 38' ' ' ASN . 2.2 tm? -136.98 154.14 50.5 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.641 ' N ' HD11 ' A' ' 37' ' ' LEU . 18.8 m120 -130.83 148.54 52.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.027 -174.88 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.505 ' HB ' HD13 ' A' ' 53' ' ' ILE . 20.6 mm -119.36 134.97 61.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 172.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.7 t -143.34 126.99 17.0 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.069 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.662 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 87.7 m95 -105.15 148.35 26.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.2 0.524 . . . . 0.0 110.382 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.56 158.23 40.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.507 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.3 t -75.68 162.58 28.11 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.756 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -58.09 -25.16 60.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.258 0.551 . . . . 0.0 110.296 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.3 m -72.95 -8.56 56.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.133 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.17 19.2 43.3 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.283 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -100.03 123.57 46.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.516 0.198 . . . . 0.0 110.868 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.08 141.69 96.77 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.317 2.678 . . . . 0.0 113.276 -176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.9 mt -113.21 147.38 37.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.168 178.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.52 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 21.9 tt0 -56.78 107.52 0.4 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.587 176.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.2 m -118.86 113.85 21.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.299 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 pttt -115.84 125.76 53.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.292 0.568 . . . . 0.0 111.175 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.505 HD13 ' HB ' ' A' ' 39' ' ' ILE . 28.2 mt -133.27 138.52 51.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.614 -174.402 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.0 134.68 40.04 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.553 HG13 ' H ' ' A' ' 57' ' ' GLU . 21.7 t 68.56 112.25 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.003 -175.749 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.97 10.96 2.96 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.855 0.836 . . . . 0.0 110.593 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.553 ' H ' HG13 ' A' ' 55' ' ' VAL . 36.0 tt0 -122.1 156.1 34.3 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 p -74.68 142.96 44.42 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.955 0.407 . . . . 0.0 110.281 -171.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -92.22 129.41 41.43 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.065 -166.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -93.86 -174.39 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.094 2.53 . . . . 0.0 112.878 176.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 m120 56.87 80.76 0.15 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.882 0.739 . . . . 0.0 112.048 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.25 -11.57 60.14 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.641 HG23 ' H ' ' A' ' 65' ' ' SER . 3.7 m -145.7 157.15 43.98 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.663 ' HD1' ' CD2' ' A' ' 64' ' ' PHE . 99.2 m-85 -131.81 23.36 4.63 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 171.86 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.641 ' H ' HG23 ' A' ' 63' ' ' THR . 2.0 m -136.96 173.54 11.59 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.288 -1.323 . . . . 0.0 111.975 -162.0 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.456 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -108.27 149.3 28.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.071 174.696 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.488 ' HG2' HD13 ' A' ' 27' ' ' LEU . 28.9 mtpp -131.69 139.37 49.02 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.494 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -137.36 129.2 4.61 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.926 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.558 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 42.1 t -115.23 132.06 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.788 0.328 . . . . 0.0 110.714 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.52 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.32 151.65 35.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.167 177.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -99.33 120.74 40.06 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.592 0.71 . . . . 0.0 110.38 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.747 HG13 ' HB1' ' A' ' 22' ' ' ALA . 2.0 t -124.25 151.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.083 -174.945 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -88.57 153.27 21.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -60.87 -36.75 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.191 0.52 . . . . 0.0 109.98 -177.585 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.409 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 9.9 mm-40 -57.54 -33.88 68.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.778 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.21 -48.33 80.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.545 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -68.78 -36.24 78.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.756 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.409 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 87.6 m-20 -64.24 -34.35 77.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.974 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -87.53 7.12 30.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.666 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.447 ' HA ' ' HD3' ' A' ' 80' ' ' ARG . 23.2 mmt180 56.58 37.81 29.11 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.76 178.311 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -63.5 159.08 19.31 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.651 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -111.63 138.07 48.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.842 175.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -122.42 154.26 37.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.29 177.276 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.503 HG23 ' CD1' ' A' ' 99' ' ' PHE . 86.2 t -123.59 128.19 74.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -173.521 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.756 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 28.9 p -106.15 140.27 39.38 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.662 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.447 HG21 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -119.19 127.02 52.91 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.773 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.499 HG22 HG23 ' A' ' 6' ' ' THR . 58.6 t -110.26 133.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.817 -178.056 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.0 p -139.06 100.67 4.09 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.176 0.512 . . . . 0.0 111.066 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.507 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 50.2 t60 -98.4 -8.19 27.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.03 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.507 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 52.2 ttt180 79.7 -27.6 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.782 0.676 . . . . 0.0 110.738 -176.183 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.41 ' H ' ' C ' ' A' ' 89' ' ' HIS . 11.9 t70 -71.17 -33.11 69.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.087 0.47 . . . . 0.0 110.75 -178.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.455 HD13 ' O ' ' A' ' 92' ' ' LEU . 0.9 OUTLIER -87.89 146.44 38.78 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-O 121.203 0.525 . . . . 0.0 110.752 177.489 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.62 -19.54 11.31 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.288 2.658 . . . . 0.0 112.813 -175.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 20.1 m -141.25 132.52 13.53 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.555 179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -61.85 140.99 88.38 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.497 2.131 . . . . 0.0 111.514 -179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -92.75 128.56 38.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.903 0.382 . . . . 0.0 110.456 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.447 ' HG2' HG21 ' A' ' 86' ' ' THR . 56.5 mtpt -106.11 141.62 37.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.679 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.756 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 30.3 mmtm -129.85 138.98 51.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.292 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.503 ' CD1' HG23 ' A' ' 84' ' ' VAL . 15.7 m-30 -100.98 137.56 39.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.86 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 ' HA ' ' A' ' 10' ' ' PRO . 13.6 tt -130.48 139.45 51.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.958 0.409 . . . . 0.0 110.722 177.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.5 p -157.38 148.7 21.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.219 176.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.454 ' HB2' ' NE1' ' A' ' 77' ' ' TRP . 27.1 tptp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.687 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.9 mtm . . . . . 0 N--CA 1.482 1.166 0 CA-C-O 120.803 0.335 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 149.08 179.09 24.67 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.072 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.11 125.95 52.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.152 0.501 . . . . 0.0 111.664 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.533 HG21 HD21 ' A' ' 31' ' ' LEU . 84.0 mt -63.29 135.95 26.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.437 174.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.6 mt -104.54 130.79 52.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.929 0.395 . . . . 0.0 110.29 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.0 p -116.86 122.57 44.74 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.14 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.657 ' HD1' ' CD2' ' A' ' 7' ' ' PHE . 98.1 m-85 -121.1 133.92 55.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.48 -179.571 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 p -112.14 134.48 53.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.22 176.896 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.428 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 34.0 mm -117.42 119.93 33.89 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.574 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.428 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 18.1 Cg_endo -58.31 139.59 91.12 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.996 2.464 . . . . 0.0 111.802 173.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.512 ' HB2' HD12 ' A' ' 16' ' ' ILE . 43.6 Cg_endo -65.96 153.14 79.34 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 123.118 2.546 . . . . 0.0 112.905 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.501 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.0 t -81.09 121.41 26.06 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 178.152 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.596 ' HE1' ' CE2' ' A' ' 13' ' ' PHE . 51.8 t80 -62.83 -34.08 76.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.105 -173.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -61.98 -46.41 89.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.449 177.889 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.25 -38.86 88.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.568 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.559 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.6 mt -58.9 -40.68 80.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.52 176.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.661 ' HE1' ' CE2' ' A' ' 17' ' ' PHE . 47.7 t80 -73.6 -43.56 59.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.073 -176.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.5 mp -62.86 -48.71 77.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.952 -177.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.2 p -86.94 -13.95 43.22 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.176 0.512 . . . . 0.0 111.07 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.81 27.06 16.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.049 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.4 m -139.08 134.0 32.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.144 174.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.559 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -87.51 142.65 27.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.509 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 39.2 m-80 -126.55 118.41 24.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.009 0.433 . . . . 0.0 110.091 -173.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 86.9 mt -82.82 139.15 33.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.959 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 30.2 m -124.9 120.62 32.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.477 0.656 . . . . 0.0 110.937 -177.449 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.556 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 42.5 t -121.48 136.67 54.94 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.413 178.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.479 ' HG ' ' OG ' ' A' ' 65' ' ' SER . 2.7 tt -131.81 130.75 42.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.499 HG12 HG22 ' A' ' 87' ' ' VAL . 12.8 t -120.76 119.5 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.687 -176.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.1 p -130.86 177.13 7.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.043 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.2 45.28 17.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.298 0.57 . . . . 0.0 111.189 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.66 HD12 HD23 ' A' ' 37' ' ' LEU . 25.4 mt -78.16 110.5 13.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.352 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.39 -50.85 62.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.407 -172.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.537 HG23 ' HB2' ' A' ' 91' ' ' ASP . 5.7 t -90.23 148.73 22.74 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.986 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -93.91 105.15 17.18 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.53 0.681 . . . . 0.0 109.968 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.459 ' HG3' ' N ' ' A' ' 36' ' ' THR . 9.5 tp10 -151.92 174.99 12.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.248 -169.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.459 ' N ' ' HG3' ' A' ' 35' ' ' GLU . 9.3 t -60.99 146.18 47.99 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 173.115 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.66 HD23 HD12 ' A' ' 31' ' ' LEU . 48.7 tp -125.13 142.18 51.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.258 0.552 . . . . 0.0 110.289 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.21 144.45 51.04 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.202 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.556 ' HB ' HG12 ' A' ' 53' ' ' ILE . 16.0 mm -119.21 134.79 61.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 175.446 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.2 t -141.26 129.89 22.75 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 119.666 -0.814 . . . . 0.0 111.508 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.556 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -105.48 146.88 28.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.687 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.51 164.19 38.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.701 179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.8 p -75.52 170.6 15.82 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -58.45 -28.51 65.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.139 0.495 . . . . 0.0 110.818 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.0 m -75.62 -8.21 56.22 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.219 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.7 21.43 43.49 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.347 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.455 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 0.8 OUTLIER -96.64 122.9 55.88 Favored Pre-proline 0 N--CA 1.443 -0.775 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.69 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.455 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 38.1 Cg_exo -59.78 139.63 89.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 123.024 2.483 . . . . 0.0 113.875 -172.307 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.407 HD21 ' HA ' ' A' ' 49' ' ' LEU . 7.1 mt -105.74 145.02 31.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.604 174.904 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -63.12 105.8 0.76 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.335 0.588 . . . . 0.0 110.325 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.407 HG21 ' HD1' ' A' ' 41' ' ' TRP . 9.2 m -112.12 134.88 53.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.269 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -109.32 122.99 48.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.017 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.556 HG12 ' HB ' ' A' ' 39' ' ' ILE . 4.5 mp -128.47 133.77 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.78 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -97.22 116.69 29.88 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.626 HG13 ' H ' ' A' ' 57' ' ' GLU . 34.7 t 78.01 116.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 124.439 1.087 . . . . 0.0 110.811 -176.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.9 mmt -78.4 12.78 1.8 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.49 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.626 ' H ' HG13 ' A' ' 55' ' ' VAL . 33.3 mt-10 -121.3 154.72 36.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.83 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -77.41 145.15 37.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -176.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.42 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 33.6 m-70 -92.72 128.0 45.75 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.536 -0.466 . . . . 0.0 109.964 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.466 ' HD2' ' H ' ' A' ' 61' ' ' ASN . 53.0 Cg_endo -99.0 -31.3 0.03 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.11 2.54 . . . . 0.0 113.79 176.805 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.466 ' H ' ' HD2' ' A' ' 60' ' ' PRO . 9.9 p30 -114.41 142.07 46.83 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.729 0.3 . . . . 0.0 110.303 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.97 -56.63 4.83 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -177.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 m -126.56 153.51 45.13 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.662 ' HE2' ' CE1' ' A' ' 64' ' ' PHE . 13.6 p90 -111.39 23.0 14.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.385 0.612 . . . . 0.0 110.249 -179.214 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.479 ' OG ' ' HG ' ' A' ' 27' ' ' LEU . 33.0 t -160.93 173.68 14.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -169.52 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.497 ' HB2' HD12 ' A' ' 39' ' ' ILE . . . -109.66 155.74 21.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.482 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 46.7 mttp -129.72 139.44 51.33 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 176.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.498 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -121.93 118.76 3.8 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.541 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 58.5 t -107.84 122.95 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.748 0.308 . . . . 0.0 110.451 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.412 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.33 141.06 48.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.902 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -98.87 114.6 27.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.28 0.562 . . . . 0.0 110.326 -177.026 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 2.5 m -119.73 166.77 13.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.774 -177.267 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.4 m -79.13 144.89 34.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.905 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 t -57.24 -30.85 36.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 173.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.96 -39.58 90.1 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.473 177.558 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -61.81 -42.35 98.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.542 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -73.02 -39.19 66.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 179.296 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -68.9 -23.95 64.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.639 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -98.02 16.8 19.97 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.423 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 17.4 mmt180 55.59 36.71 27.72 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.969 173.556 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -71.98 157.59 37.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.373 0.606 . . . . 0.0 111.958 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.4 mp0 -109.23 139.11 44.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.433 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.655 ' HD2' ' CD1' ' A' ' 83' ' ' PHE . 71.8 m-85 -125.37 151.81 45.62 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.219 178.44 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.9 t -122.2 122.74 67.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.399 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.713 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 20.6 p -105.6 133.37 50.45 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.535 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -126.4 128.38 46.93 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -178.076 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.499 HG22 HG12 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -119.84 127.41 75.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.039 0.447 . . . . 0.0 112.155 -174.979 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.0 m -112.18 108.51 17.79 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.191 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -101.21 -8.81 21.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.091 177.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.434 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 13.0 ttt180 74.15 -3.84 2.43 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.333 0.587 . . . . 0.0 110.317 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.537 ' HB2' HG23 ' A' ' 33' ' ' THR . 5.5 t70 -73.23 -36.32 66.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.569 -177.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.445 HD11 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -122.61 154.16 63.12 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.577 -176.563 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -68.08 -20.69 43.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.254 2.636 . . . . 0.0 112.476 -176.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.48 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 13.7 m -129.04 111.37 18.4 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.259 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.535 ' HB2' HG23 ' A' ' 86' ' ' THR . 11.8 Cg_endo -55.21 148.45 49.76 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.722 2.281 . . . . 0.0 110.919 174.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.447 ' O ' ' HA ' ' A' ' 86' ' ' THR . 40.9 mt-30 -90.8 127.42 36.34 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.759 -171.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.597 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 15.9 ptmt -110.14 129.92 55.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.304 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.713 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 67.6 mmtt -122.92 140.9 52.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.686 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.602 ' HE2' ' CE1' ' A' ' 99' ' ' PHE . 89.2 m-85 -100.68 122.99 44.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.368 -178.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.9 tt -122.86 139.29 50.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.52 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 3.7 p -157.47 148.87 21.82 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.245 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.542 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 49.5 tttp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.098 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.926 0.394 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.23 77.31 0.34 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -133.25 130.3 38.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -176.719 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.439 HG21 HD21 ' A' ' 31' ' ' LEU . 59.6 mt -66.95 120.5 14.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.391 0.432 . . . . 0.0 110.237 -176.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.5 mt -108.77 134.41 51.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.17 0.509 . . . . 0.0 111.192 -175.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.497 ' HB ' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -107.39 127.72 53.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.112 -177.904 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.668 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 94.9 m-85 -127.34 143.15 51.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -119.63 137.86 53.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.742 0.306 . . . . 0.0 110.664 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.541 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.17 123.46 30.05 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.995 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.515 ' HA ' HD12 ' A' ' 100' ' ' ILE . 61.1 Cg_endo -70.91 148.73 58.22 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 123.124 2.549 . . . . 0.0 112.066 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.25 149.33 81.38 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.585 2.19 . . . . 0.0 111.75 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.421 ' O ' HG13 ' A' ' 16' ' ' ILE . 2.8 t -103.27 143.99 31.93 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.035 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -58.23 -30.59 66.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.458 -172.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.452 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -67.75 -44.18 78.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.782 0.325 . . . . 0.0 110.314 175.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.82 -45.95 91.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.16 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 12' ' ' SER . 51.9 mt -61.01 -29.89 46.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.363 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.95 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -72.3 -43.92 63.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.109 0.48 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.452 HD21 ' O ' ' A' ' 14' ' ' ALA . 4.3 mm? -67.27 -49.53 63.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.262 -176.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 p -93.82 0.84 56.46 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 87.2 tttt 69.51 -48.9 0.61 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.4 0.68 . . . . 0.0 111.165 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.437 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 13.8 m -89.38 151.21 22.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.916 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.3 155.88 24.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.209 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -129.86 126.41 37.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.064 0.459 . . . . 0.0 110.588 -176.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.411 HD23 HD11 ' A' ' 100' ' ' ILE . 52.7 mt -89.39 138.45 31.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.81 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.541 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 19.2 m -120.8 129.2 53.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.018 0.437 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.545 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 47.0 t -109.75 137.38 47.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.169 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.517 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 2.8 tm? -126.34 123.73 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 87' ' ' VAL . 15.4 t -123.89 119.63 57.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.9 p -133.71 177.39 7.75 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -173.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 59.46 40.74 20.32 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.428 177.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.629 HD12 HD23 ' A' ' 37' ' ' LEU . 58.6 mt -64.1 127.43 31.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.187 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.82 -27.84 69.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.651 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.0 p -125.91 147.87 49.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.065 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -95.26 44.91 1.09 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.3 0.572 . . . . 0.0 110.56 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -91.27 -174.73 4.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.274 177.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.1 m -66.16 136.31 55.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.892 0.377 . . . . 0.0 110.587 176.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.629 HD23 HD12 ' A' ' 31' ' ' LEU . 49.3 tp -115.43 151.29 35.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -135.0 161.72 34.49 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.519 HG22 ' HA3' ' A' ' 68' ' ' GLY . 27.8 mm -121.86 151.91 25.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -177.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 37.3 m -149.98 123.74 9.23 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.084 -0.385 . . . . 0.0 111.109 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.437 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 67.4 m95 -107.76 144.87 34.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.174 0.512 . . . . 0.0 111.246 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.76 157.07 34.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.067 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.657 ' HB2' ' CG ' ' A' ' 47' ' ' GLU . 14.7 m -88.26 162.65 16.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.046 0.45 . . . . 0.0 109.926 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.3 -25.05 8.52 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.891 -1.05 . . . . 0.0 113.821 -170.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -88.1 -0.78 57.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.857 0.361 . . . . 0.0 111.403 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.16 22.16 28.18 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.324 -0.465 . . . . 0.0 112.061 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.657 ' CG ' ' HB2' ' A' ' 43' ' ' SER . 8.2 pt-20 -100.4 128.76 29.51 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.731 0.301 . . . . 0.0 110.595 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 35.7 Cg_exo -61.13 141.55 94.08 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.33 2.687 . . . . 0.0 113.77 -173.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.492 HD12 ' CD1' ' A' ' 83' ' ' PHE . 8.5 mt -108.19 147.71 30.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.959 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.407 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 4.2 mp0 -62.39 106.2 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.632 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.5 m -143.92 114.06 7.37 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -96.79 120.01 36.33 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.467 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 60.6 mt -134.99 119.27 26.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.075 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -130.24 105.28 7.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 164.286 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -143.75 136.9 24.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.449 0.642 . . . . 0.0 111.57 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.2 ttm -109.24 -25.11 10.77 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.901 171.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -124.44 156.02 37.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.281 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -78.51 160.76 27.49 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.525 ' HB3' ' OD1' ' A' ' 61' ' ' ASN . 73.6 m-70 -92.88 128.7 42.57 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -175.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.41 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 94.4 Cg_endo -94.73 25.42 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.91 2.407 . . . . 0.0 113.363 -177.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.525 ' OD1' ' HB3' ' A' ' 59' ' ' HIS . 3.3 p-10 -97.07 107.22 19.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.549 0.69 . . . . 0.0 110.735 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.37 -42.48 3.14 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.265 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -148.57 168.57 22.41 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.632 ' HD2' ' CD1' ' A' ' 64' ' ' PHE . 49.1 p90 -87.48 26.11 1.32 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.225 0.536 . . . . 0.0 111.294 179.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.574 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 17.3 m -110.92 173.59 6.26 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -165.303 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.569 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -106.69 146.0 31.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.861 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 55.6 mtpt -132.48 140.76 48.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.462 -175.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.519 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -129.33 139.37 10.91 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 53.6 t -114.44 124.5 71.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.0 0.429 . . . . 0.0 110.79 -174.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.407 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -115.69 134.64 54.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.83 177.834 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.8 m -98.92 123.38 43.16 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.081 0.467 . . . . 0.0 110.166 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.437 ' O ' ' HB3' ' A' ' 21' ' ' SER . 4.0 m -122.03 165.32 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.929 -175.836 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.1 t -86.69 150.06 24.45 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 t -63.82 -24.28 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -65.14 -36.53 84.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.731 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.412 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 59.7 m-20 -68.18 -44.67 75.4 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.448 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -69.18 -35.28 76.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.478 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -70.54 -27.7 64.35 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.587 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -92.94 7.67 43.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.918 0.39 . . . . 0.0 110.326 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.9 mtt-85 58.34 37.49 25.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.28 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 53.3 mtpt -67.1 156.48 36.03 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.977 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.51 139.23 43.55 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.273 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.492 ' CD1' HD12 ' A' ' 49' ' ' LEU . 64.8 m-85 -124.71 150.62 45.98 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.128 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 94.7 t -125.27 131.47 72.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.752 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 30.6 p -106.31 126.28 52.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.48 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.539 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 p -112.05 137.64 49.81 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.658 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.681 HG12 HG12 ' A' ' 28' ' ' VAL . 44.7 t -116.59 127.42 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.603 -175.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . 0.501 HG21 ' HB3' ' A' ' 95' ' ' PRO . 1.4 p -119.02 94.22 4.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.684 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 1.3 t60 -85.34 -50.78 7.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.33 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.684 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 3.2 tmm_? 151.69 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.758 1.286 . . . . 0.0 108.307 -176.737 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -71.37 -30.41 66.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.662 -1.154 . . . . 0.0 112.177 -167.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.32 148.23 43.41 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-O 121.105 0.479 . . . . 0.0 111.067 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -78.61 -26.86 5.47 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.271 2.647 . . . . 0.0 111.96 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.6 p -118.39 122.3 30.28 Favored Pre-proline 0 N--CA 1.445 -0.684 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.518 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.525 ' HB2' ' HB ' ' A' ' 86' ' ' THR . 18.7 Cg_endo -60.5 140.72 92.83 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.198 1.932 . . . . 0.0 111.997 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.539 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.9 pt20 -78.94 135.11 36.86 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -113.31 128.01 56.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.315 0.579 . . . . 0.0 111.782 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.497 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 6.2 tmtt? -121.98 140.91 51.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.178 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -100.35 147.55 25.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.836 0.35 . . . . 0.0 111.101 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.515 HD12 ' HA ' ' A' ' 10' ' ' PRO . 12.6 tt -133.77 138.55 50.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.455 176.427 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 56.9 p -158.3 149.94 21.34 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.65 -0.69 . . . . 0.0 110.26 179.254 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tpt . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.904 0.383 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.837 ' HA3' ' HB3' ' A' ' 32' ' ' ALA . . . 174.38 56.42 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.612 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -68.62 118.47 11.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.689 0.281 . . . . 0.0 110.678 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.538 HG21 HD21 ' A' ' 31' ' ' LEU . 69.3 mt -60.39 121.81 9.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.308 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.413 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 83.4 mt -108.95 140.32 42.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.003 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.51 ' HB ' HG22 ' A' ' 87' ' ' VAL . 2.5 t -134.21 125.41 27.76 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.202 0.525 . . . . 0.0 110.517 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -121.52 141.9 50.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.483 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.446 ' HB ' HD13 ' A' ' 100' ' ' ILE . 16.7 p -113.55 132.44 55.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.012 0.434 . . . . 0.0 111.48 -178.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.44 124.34 29.07 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.089 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -77.91 145.0 22.08 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 123.153 2.569 . . . . 0.0 112.267 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.0 147.76 49.72 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 122.453 2.102 . . . . 0.0 111.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.91 155.17 16.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.096 -176.378 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -56.47 -43.97 80.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.555 0.217 . . . . 0.0 111.487 -173.511 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -45.89 92.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.149 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.22 -40.06 95.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.045 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.36 -30.58 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.704 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.658 ' HE2' ' CE1' ' A' ' 17' ' ' PHE . 43.6 t80 -71.85 -43.96 64.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.853 -174.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.45 -48.15 61.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.734 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.5 p -80.91 -13.09 59.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.54 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 60.16 21.26 10.56 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.865 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.3 m -137.82 137.75 38.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.349 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.561 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -97.12 148.91 22.56 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.548 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.4 p30 -157.73 127.73 6.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.001 0.429 . . . . 0.0 110.484 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.447 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -84.41 146.94 27.39 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.063 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.7 m -124.22 120.97 33.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.169 0.509 . . . . 0.0 111.154 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.564 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.4 t -113.27 137.69 51.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.597 HD13 ' HG2' ' A' ' 67' ' ' LYS . 1.2 tt -131.9 138.08 48.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.854 0.359 . . . . 0.0 110.629 175.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.583 HG23 ' H ' ' A' ' 66' ' ' ALA . 4.4 m -115.03 147.1 18.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.539 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.3 p -143.19 175.25 10.02 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.708 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 59.1 31.99 21.77 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.538 HD21 HG21 ' A' ' 4' ' ' ILE . 49.5 mt -71.34 118.36 14.04 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.012 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.837 ' HB3' ' HA3' ' A' ' 2' ' ' GLY . . . -75.37 -49.63 18.44 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.163 0.506 . . . . 0.0 110.573 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 p -84.52 152.36 23.97 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.982 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -110.38 150.69 28.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.433 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.423 ' O ' ' HE1' ' A' ' 89' ' ' HIS . 47.1 mt-10 66.75 164.99 0.2 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.994 0.809 . . . . 0.0 111.863 -178.465 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.4 m 64.5 60.74 0.89 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.463 176.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.686 HD11 ' N ' ' A' ' 38' ' ' ASN . 2.0 tm? -125.16 156.24 38.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 170.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.686 ' N ' HD11 ' A' ' 37' ' ' LEU . 4.7 t-20 -149.44 155.39 40.34 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.627 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.51 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.1 mm -120.87 135.23 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 t -138.73 147.46 42.72 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.564 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -123.7 149.3 45.67 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.372 177.066 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -147.07 150.93 36.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 m -74.73 150.6 39.38 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.529 HE22 ' HD1' ' A' ' 99' ' ' PHE . 8.8 tp-100 -52.59 -24.7 8.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.6 p -73.5 -6.72 48.23 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.175 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.24 19.92 37.39 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.99 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -100.02 121.5 53.74 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -178.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 24.3 Cg_exo -63.55 139.6 71.01 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.826 2.351 . . . . 0.0 112.93 -175.612 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.429 HD21 ' HA ' ' A' ' 49' ' ' LEU . 10.5 mt -107.07 145.43 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.596 178.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -72.0 106.85 4.44 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.929 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 m -104.11 124.98 50.05 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.44 -176.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 59.0 tttm -122.63 136.76 54.97 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.595 HG12 ' HA2' ' A' ' 68' ' ' GLY . 81.1 mt -110.26 133.78 54.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.257 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.306 -177.952 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -95.65 140.17 30.84 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 174.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t 70.89 105.88 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 O-C-N 124.275 0.984 . . . . 0.0 108.443 -162.162 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -72.41 -0.92 13.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.587 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -124.51 154.3 40.76 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.079 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -77.96 169.04 18.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.367 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.447 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 37.8 m-70 -86.51 144.7 38.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.871 -170.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.495 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 11.3 Cg_exo -70.51 144.65 50.62 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.62 2.88 . . . . 0.0 115.622 -163.222 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.655 ' HB3' ' HB2' ' A' ' 64' ' ' PHE . 2.7 t-20 152.02 42.64 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.348 1.859 . . . . 0.0 106.351 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.05 -69.0 2.24 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 107.161 -2.376 . . . . 0.0 107.161 -157.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.447 HG23 HD13 ' A' ' 31' ' ' LEU . 32.4 m -154.22 146.17 23.56 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 158.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.655 ' HB2' ' HB3' ' A' ' 61' ' ' ASN . 81.1 t80 -134.86 -31.91 1.0 Allowed 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.969 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.531 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 32.7 t -163.16 151.32 13.72 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.963 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.583 ' H ' HG23 ' A' ' 28' ' ' VAL . . . -132.73 155.93 47.96 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.236 170.796 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.597 ' HG2' HD13 ' A' ' 27' ' ' LEU . 29.5 mtpp -131.93 140.18 48.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.595 ' HA2' HG12 ' A' ' 53' ' ' ILE . . . -138.95 132.51 5.76 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.354 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.434 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 60.9 t -116.53 133.33 63.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.896 0.379 . . . . 0.0 110.525 -177.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.548 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.06 139.33 49.96 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.611 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.3 m -97.69 119.0 35.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.005 0.431 . . . . 0.0 110.544 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.561 HG21 ' HB1' ' A' ' 22' ' ' ALA . 11.7 m -130.49 166.53 27.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.859 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.73 150.83 36.23 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.2 t -61.0 -32.98 53.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.73 0.776 . . . . 0.0 109.151 177.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -56.85 -38.81 73.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.94 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.08 -41.08 91.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 -175.436 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -34.31 62.71 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.673 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.8 m-20 -69.91 -20.38 63.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.656 178.354 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -102.3 8.16 40.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.023 0.439 . . . . 0.0 110.772 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 59.74 38.12 21.82 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.753 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -63.58 164.09 10.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.094 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.499 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 42.1 mp0 -107.64 137.17 46.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.602 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.529 ' O ' HG23 ' A' ' 100' ' ' ILE . 60.0 m-85 -129.58 148.24 51.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.875 174.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 2.6 p -133.19 135.12 57.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.658 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.4 p -104.74 142.92 33.85 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.111 0.481 . . . . 0.0 110.808 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.512 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -113.96 130.22 56.54 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.732 176.237 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.51 HG22 ' HB ' ' A' ' 6' ' ' THR . 59.0 t -104.64 127.15 59.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.783 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 m -127.47 94.5 4.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.424 0.63 . . . . 0.0 110.726 -173.396 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 91' ' ' ASP . 1.4 t60 -99.54 -10.84 21.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.045 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.4 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 0.8 OUTLIER 69.89 -6.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.692 0.758 . . . . 0.0 109.552 -172.609 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.494 ' H ' ' C ' ' A' ' 89' ' ' HIS . 19.8 t70 -72.82 -29.43 63.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.32 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -118.57 154.47 52.46 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.319 178.843 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.64 -20.33 17.89 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.118 2.545 . . . . 0.0 112.937 -177.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.424 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 52.1 p -132.13 118.57 16.32 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.424 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 18.6 Cg_endo -58.22 141.11 96.46 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.749 2.299 . . . . 0.0 111.362 177.79 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.512 ' O ' ' HA ' ' A' ' 86' ' ' THR . 45.4 mt-30 -83.9 149.71 26.18 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.636 -177.094 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.485 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 28.3 mtpp -125.74 137.31 53.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 -176.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.658 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 71.3 mmtt -129.9 133.96 47.19 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.529 ' HD1' HE22 ' A' ' 44' ' ' GLN . 42.3 m-85 -101.23 124.41 46.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.33 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.529 HG23 ' O ' ' A' ' 83' ' ' PHE . 13.0 tt -122.0 141.3 42.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.896 0.379 . . . . 0.0 111.15 -178.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.499 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 22.8 p -156.86 149.53 23.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.469 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.921 -0.561 . . . . 0.0 109.489 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.2 mmt . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.887 0.375 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.64 178.15 23.48 Favored Glycine 0 N--CA 1.445 -0.735 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.961 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -101.4 122.43 43.73 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.67 0.272 . . . . 0.0 110.643 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.487 HG21 HD21 ' A' ' 31' ' ' LEU . 28.2 mt -62.18 121.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.591 -176.453 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.5 mt -115.49 132.83 56.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.1 t -121.31 130.54 53.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.623 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 85.6 m-85 -125.0 146.65 49.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.519 178.32 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.1 p -116.41 137.79 51.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.061 0.458 . . . . 0.0 111.12 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -117.89 126.6 27.18 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.974 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.526 ' HA ' HD12 ' A' ' 100' ' ' ILE . 96.0 Cg_endo -78.7 148.36 22.69 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 123.048 2.499 . . . . 0.0 112.55 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -77.51 150.16 27.91 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.601 2.201 . . . . 0.0 111.506 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.475 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.7 t -88.97 149.14 23.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.512 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.666 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 76.2 t80 -54.3 -43.31 71.01 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -174.594 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.407 ' O ' HD11 ' A' ' 18' ' ' LEU . . . -60.97 -46.26 91.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.421 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.92 -37.15 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.176 -177.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.475 HG13 ' O ' ' A' ' 12' ' ' SER . 71.0 mt -61.46 -36.92 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.079 0.466 . . . . 0.0 110.434 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.634 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 56.7 t80 -72.22 -43.82 63.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.187 -178.212 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD11 ' O ' ' A' ' 14' ' ' ALA . 10.8 mp -66.92 -48.45 68.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.235 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.483 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -75.51 -12.81 60.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.476 -178.443 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 70.79 -10.65 0.71 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.298 0.639 . . . . 0.0 111.131 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.483 ' H ' ' C ' ' A' ' 19' ' ' SER . 10.0 p -138.72 147.38 42.65 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.233 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.606 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -88.08 156.78 19.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.629 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 31.1 m-80 -139.42 116.84 11.3 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.639 -171.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.585 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.43 144.1 44.43 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 174.587 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.499 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 39.1 m -125.27 124.21 41.16 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.086 0.47 . . . . 0.0 110.415 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.417 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 26.2 t -112.1 136.93 50.86 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.818 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -125.08 122.68 37.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.435 ' O ' ' HA ' ' A' ' 65' ' ' SER . 24.3 t -121.98 126.42 74.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.7 m -139.14 176.39 8.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.383 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 57.32 50.61 11.23 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.86 0.725 . . . . 0.0 111.242 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.487 HD21 HG21 ' A' ' 4' ' ' ILE . 65.2 mt -74.66 149.55 39.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.742 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.84 56.52 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.9 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 70.3 p -99.1 -164.38 1.12 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.524 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -102.56 -25.23 13.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.989 0.423 . . . . 0.0 110.234 178.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -163.51 -174.11 3.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.038 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.653 ' HA ' ' HG3' ' A' ' 57' ' ' GLU . 28.8 m 74.88 109.38 0.07 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.581 0.55 . . . . 0.0 111.441 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.546 ' HB3' ' HB3' ' A' ' 58' ' ' SER . 54.8 tp -166.85 149.84 6.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.695 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -128.29 157.61 40.45 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.303 0.377 . . . . 0.0 110.302 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.548 HG22 ' HA3' ' A' ' 68' ' ' GLY . 22.7 mm -122.14 137.63 55.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 t -136.26 143.77 44.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.685 0.279 . . . . 0.0 110.369 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 66.7 m95 -129.15 145.82 51.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.981 0.419 . . . . 0.0 110.785 177.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.78 139.82 17.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.591 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.524 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 29.5 t -66.36 155.26 37.86 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.117 0.484 . . . . 0.0 110.387 174.515 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -62.89 -24.1 67.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.185 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.4 m -76.67 -3.77 39.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.051 179.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.83 21.7 38.78 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.755 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.524 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 21.5 mt-10 -92.67 121.1 66.8 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.409 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 17.1 Cg_exo -66.12 134.23 35.96 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.932 1.755 . . . . 0.0 111.419 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.899 HD13 ' HB2' ' A' ' 70' ' ' ALA . 1.7 mm? -102.68 141.48 35.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.302 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -92.01 107.4 19.18 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.656 176.518 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.0 m -98.69 133.91 42.35 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.832 -174.563 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.466 ' HB2' HG11 ' A' ' 69' ' ' VAL . 47.8 mtmt -94.28 123.17 37.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.515 HD12 ' HB ' ' A' ' 39' ' ' ILE . 30.9 mm -124.94 120.78 59.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.213 -175.038 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.406 ' O ' ' HB ' ' A' ' 55' ' ' VAL . 91.8 mttt -97.29 110.13 22.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.458 ' C ' ' H ' ' A' ' 57' ' ' GLU . 86.3 t 73.5 114.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.385 -168.359 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -67.46 8.77 0.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.653 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 33.7 tt0 -132.81 154.81 49.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -176.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.557 ' HB3' ' HB3' ' A' ' 66' ' ' ALA . 22.9 p -76.23 148.57 37.56 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -176.553 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.415 ' HB2' ' HB ' ' A' ' 63' ' ' THR . 14.0 m-70 -92.57 124.89 57.77 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.852 -172.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -107.08 0.61 0.15 Allowed 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.88 3.053 . . . . 0.0 113.93 177.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -97.97 -79.78 0.46 Allowed 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.224 -174.558 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -87.18 6.44 83.33 Favored Glycine 0 CA--C 1.509 -0.287 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.497 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.415 ' HB ' ' HB2' ' A' ' 59' ' ' HIS . 4.9 m -149.5 166.11 30.16 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.664 ' HE1' ' CE2' ' A' ' 64' ' ' PHE . 26.0 m-85 -124.12 22.63 8.65 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 176.62 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.435 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 1.4 m -144.39 162.35 36.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.305 -167.77 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.557 ' HB3' ' HB3' ' A' ' 58' ' ' SER . . . -109.54 149.81 29.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.064 164.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.417 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 39.5 mtpt -131.94 141.24 49.26 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.548 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -137.63 131.66 5.59 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.6 -177.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.585 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -122.93 124.13 69.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.989 0.423 . . . . 0.0 110.632 -177.139 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.899 ' HB2' HD13 ' A' ' 49' ' ' LEU . . . -116.36 147.38 41.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.351 -176.115 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -104.85 123.64 48.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.988 0.423 . . . . 0.0 111.309 -172.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.606 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 6.4 m -125.38 164.4 24.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.281 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.4 t -82.21 153.72 25.8 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.47 -33.75 52.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.154 0.502 . . . . 0.0 110.256 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -59.93 -33.34 71.76 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.863 -179.191 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.426 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 15.6 m-20 -64.55 -42.43 95.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.436 0.636 . . . . 0.0 109.387 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.0 OUTLIER -74.03 -35.44 64.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.546 179.071 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 69.3 m-20 -64.23 -33.42 75.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.341 178.538 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -90.72 8.23 35.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.112 0.482 . . . . 0.0 110.663 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 54.5 38.28 29.42 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.345 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 57.3 mtpt -66.36 159.81 26.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.751 175.763 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -118.08 141.22 48.71 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.972 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 96.6 m-85 -120.04 151.57 38.81 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.224 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.464 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.9 t -121.42 129.41 75.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.583 -173.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.604 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 45.1 t -105.77 122.39 46.0 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.496 -0.482 . . . . 0.0 109.714 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.8 112.2 25.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.185 0.517 . . . . 0.0 110.701 176.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.421 ' HB ' ' CG ' ' A' ' 96' ' ' GLN . 43.2 t -97.53 125.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.126 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.5 m -118.46 112.81 20.44 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.619 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.473 ' HB3' ' OD1' ' A' ' 91' ' ' ASP . 7.3 t-160 -97.98 -50.4 4.42 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.058 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.466 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 42.4 ttm180 144.89 -33.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 O-C-N 125.396 1.685 . . . . 0.0 109.947 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.473 ' OD1' ' HB3' ' A' ' 89' ' ' HIS . 0.0 OUTLIER -72.04 -35.19 69.27 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.959 -168.941 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.64 146.05 32.39 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 121.426 0.631 . . . . 0.0 111.301 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.14 -19.24 26.42 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 123.54 2.827 . . . . 0.0 112.466 -174.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 24.0 t -144.13 135.54 12.69 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.74 141.4 95.61 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.047 2.498 . . . . 0.0 112.396 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.421 ' CG ' ' HB ' ' A' ' 87' ' ' VAL . 3.5 pt20 -81.42 133.25 35.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.818 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.604 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.3 ptpt -114.82 142.71 46.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.304 0.574 . . . . 0.0 111.707 -175.292 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 32.7 mmtm -129.73 140.0 51.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.232 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.661 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 79.3 m-85 -101.36 133.45 45.94 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.035 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.526 HD12 ' HA ' ' A' ' 10' ' ' PRO . 12.4 tt -128.68 136.3 60.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.996 0.426 . . . . 0.0 111.182 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.3 p -158.74 146.72 18.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.074 176.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.633 -176.484 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 tmm? . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.81 152.58 19.76 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.6 119.03 9.73 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.824 0.312 . . . . 0.0 110.225 -178.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.771 HD13 ' N ' ' A' ' 36' ' ' THR . 68.1 mt -60.37 129.08 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 169.182 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.3 mt -104.1 128.82 51.76 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.156 -171.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.412 HG21 ' HD3' ' A' ' 98' ' ' LYS . 4.1 t -120.3 129.31 53.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.717 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -131.13 141.98 50.19 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.738 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 p -113.08 133.63 54.91 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.848 176.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.424 HD13 ' N ' ' A' ' 9' ' ' ILE . 4.3 mp -116.58 124.8 29.01 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.051 -175.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.543 ' HA ' HD12 ' A' ' 100' ' ' ILE . 52.5 Cg_endo -69.57 139.1 40.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.694 2.262 . . . . 0.0 111.687 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.493 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 55.7 Cg_endo -65.82 144.17 76.35 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.886 2.39 . . . . 0.0 111.837 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.1 m -85.64 148.59 25.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.641 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -54.71 -42.38 71.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.727 0.24 . . . . 0.0 111.275 -173.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.45 ' O ' HD11 ' A' ' 18' ' ' LEU . . . -57.81 -45.1 86.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.325 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.83 -42.19 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.85 0.357 . . . . 0.0 110.817 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.45 ' HA ' ' O ' ' A' ' 21' ' ' SER . 62.1 mt -66.15 -38.82 82.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.661 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -74.03 -43.25 58.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.12 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.45 HD11 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -64.25 -47.7 78.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.727 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 78.6 p -85.98 -12.31 50.71 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.233 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp 65.47 17.43 10.95 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.742 -176.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.45 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 23.1 m -139.13 147.21 41.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.394 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.555 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -92.04 136.72 32.95 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -114.17 122.95 48.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.635 -173.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.462 ' HB2' ' HB1' ' A' ' 70' ' ' ALA . 83.4 mt -85.3 125.4 32.89 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.668 177.376 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.9 m -113.64 123.98 51.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.314 0.578 . . . . 0.0 111.434 -176.077 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.552 ' HB3' HD13 ' A' ' 39' ' ' ILE . 18.2 t -124.38 137.05 54.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.656 176.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.51 124.22 26.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.515 ' HB ' HD13 ' A' ' 37' ' ' LEU . 12.1 t -119.2 129.92 74.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.5 p -143.19 177.37 8.45 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.228 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.505 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 15.2 m120 62.53 50.33 3.64 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.706 0.765 . . . . 0.0 109.772 174.322 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.695 HD12 ' CB ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -74.56 65.9 1.34 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.869 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -83.31 -2.75 56.45 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.641 -1.618 . . . . 0.0 109.883 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.53 ' HA ' HD12 ' A' ' 4' ' ' ILE . 80.6 p 72.14 101.35 0.07 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.125 175.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.623 ' HE2' ' CE1' ' A' ' 34' ' ' TYR . 58.1 t80 173.36 -21.07 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.725 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.809 ' HA ' HD22 ' A' ' 92' ' ' LEU . 5.6 mm-40 -144.02 38.26 1.31 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.97 ' HB ' HD12 ' A' ' 92' ' ' LEU . 15.1 t 48.4 155.34 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 169.451 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.989 ' H ' ' HB2' ' A' ' 89' ' ' HIS . 0.6 OUTLIER -150.71 149.3 29.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.911 175.538 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.623 ' N ' ' HB ' ' A' ' 87' ' ' VAL . 63.7 t30 163.45 175.55 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 166.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.552 HD13 ' HB3' ' A' ' 26' ' ' CYS . 14.7 mm -122.9 130.47 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 C-N-CA 118.77 -1.172 . . . . 0.0 109.794 169.4 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.8 t -155.53 121.88 5.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.418 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.498 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 78.0 m95 -103.04 142.27 34.39 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.447 0.641 . . . . 0.0 111.663 -174.052 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.05 164.97 36.11 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.116 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.468 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 86.9 p -82.17 168.39 17.74 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 177.685 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -63.7 -22.82 67.1 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.292 0.567 . . . . 0.0 110.259 174.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -87.43 -5.49 58.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.222 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.36 22.37 29.59 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.793 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.468 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 6.5 pt-20 -93.09 133.14 29.21 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 117.449 0.624 . . . . 0.0 109.433 176.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 16.3 Cg_exo -67.8 136.52 38.98 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.689 2.259 . . . . 0.0 112.306 -177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.438 HD21 ' HA ' ' A' ' 49' ' ' LEU . 11.2 mt -109.02 140.83 42.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.785 178.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.35 107.22 0.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.475 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 7.8 m -131.09 126.29 35.39 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.745 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -103.45 123.06 46.16 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.326 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.532 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 49.6 mm -124.5 131.31 72.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.619 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -101.8 108.47 19.97 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.247 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.632 HG13 ' H ' ' A' ' 57' ' ' GLU . 47.4 t 72.35 120.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 O-C-N 124.213 0.946 . . . . 0.0 110.425 -173.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 83.7 mtp -79.26 10.26 3.84 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.268 0.556 . . . . 0.0 111.269 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.632 ' H ' HG13 ' A' ' 55' ' ' VAL . 37.6 mt-10 -121.96 156.04 34.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.461 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 34.0 t -77.11 157.16 31.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.329 -172.266 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -103.85 124.58 37.25 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -108.84 13.68 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 123.69 2.927 . . . . 0.0 113.344 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -93.25 -84.68 0.29 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.124 -176.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.79 2.17 79.51 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.43 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 m -142.99 169.3 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -129.77 23.4 5.38 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.036 0.445 . . . . 0.0 110.347 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 m -154.49 168.67 25.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 112.193 -172.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.26 135.35 50.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.076 168.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -131.14 138.88 49.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.532 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -144.89 141.22 9.77 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 48.0 t -123.67 133.74 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.629 0.252 . . . . 0.0 110.739 -174.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.462 ' HB1' ' HB2' ' A' ' 24' ' ' LEU . . . -116.15 142.61 46.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 p -100.0 115.46 29.75 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.956 0.408 . . . . 0.0 111.175 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.555 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 1.9 m -119.44 166.47 13.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.867 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.1 t -81.02 151.89 28.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.24 -24.99 36.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.86 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.71 -34.76 77.52 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.987 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.41 -49.75 76.58 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.453 0.644 . . . . 0.0 109.778 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.565 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -67.78 -34.26 76.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.753 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -68.97 -30.37 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.26 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -92.93 8.58 39.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.325 . . . . 0.0 110.602 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 59.89 36.76 21.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.475 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -63.41 154.67 31.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.298 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -118.27 139.31 51.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.558 177.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.596 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 87.5 m-85 -122.64 162.85 21.13 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.49 -176.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.577 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.7 t -131.35 126.35 58.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.984 -175.684 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 45.9 t -111.44 123.51 50.36 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.424 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -110.68 125.62 53.65 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.623 ' HB ' ' N ' ' A' ' 38' ' ' ASN . 1.6 m -107.23 145.63 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.152 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.233 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -143.45 81.2 1.7 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.521 0.676 . . . . 0.0 112.537 -164.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.989 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 35.4 t60 -82.63 -9.15 59.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.54 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.14 21.07 12.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -170.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.474 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 9.2 t70 -84.46 -33.48 23.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.369 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.97 HD12 ' HB ' ' A' ' 36' ' ' THR . 0.3 OUTLIER -136.53 163.11 52.19 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.167 -179.399 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.23 -31.13 14.89 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.51 2.14 . . . . 0.0 112.651 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.435 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 3.9 p -109.5 102.49 49.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.474 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.435 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 37.9 Cg_endo -64.11 152.38 81.31 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 123.198 2.599 . . . . 0.0 111.666 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.616 ' NE2' ' HB3' ' A' ' 35' ' ' GLU . 35.6 mt-30 -95.82 130.51 42.73 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.052 -175.065 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -105.78 132.85 51.41 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.893 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.577 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 3.5 mmmp? -114.52 137.51 51.76 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.544 -178.634 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -101.28 138.85 37.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.811 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.543 HD12 ' HA ' ' A' ' 10' ' ' PRO . 11.4 tt -144.24 137.64 23.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 p -157.51 149.56 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.838 0.351 . . . . 0.0 111.347 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.565 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 21.5 tptm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.028 177.526 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mmt . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.23 51.61 13.11 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 124.83 27.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.556 -0.822 . . . . 0.0 110.836 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.405 HG21 ' CD1' ' A' ' 31' ' ' LEU . 69.4 mt -66.97 122.26 17.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.681 -174.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -105.62 135.3 47.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.395 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.465 HG21 ' HE2' ' A' ' 98' ' ' LYS . 4.3 t -125.9 130.16 50.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.271 0.558 . . . . 0.0 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -126.6 136.41 52.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.808 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 p -113.75 132.18 55.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.035 0.445 . . . . 0.0 111.391 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -119.21 126.0 27.29 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.203 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.403 ' HA ' HD12 ' A' ' 100' ' ' ILE . 72.9 Cg_endo -73.84 145.79 36.85 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.844 2.362 . . . . 0.0 111.815 176.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -64.21 151.54 84.96 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.5 2.134 . . . . 0.0 111.928 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 p -97.33 151.6 19.75 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.817 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -54.04 -43.45 70.19 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.692 0.282 . . . . 0.0 111.489 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.466 ' O ' HD21 ' A' ' 18' ' ' LEU . . . -64.09 -46.35 84.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.125 -178.223 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -64.66 -41.24 96.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.059 -176.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.75 -36.61 76.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.709 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 69.3 t80 -73.45 -45.39 54.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.051 0.453 . . . . 0.0 111.099 -177.427 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.466 HD21 ' O ' ' A' ' 14' ' ' ALA . 4.5 mm? -67.24 -48.28 68.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -74.01 -20.25 60.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.13 0.49 . . . . 0.0 110.888 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 64.44 11.03 6.21 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.917 0.865 . . . . 0.0 110.301 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 m -138.78 141.56 38.79 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.268 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.552 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -86.92 155.4 20.23 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.592 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.3 p30 -158.17 129.15 6.42 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.867 0.365 . . . . 0.0 110.738 -173.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.453 HD11 ' N ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -87.1 142.99 27.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.02 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.9 m -122.31 116.98 25.02 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.627 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.5 t -111.42 131.56 55.1 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.742 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.407 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.2 tt -121.44 128.89 52.6 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.17 0.509 . . . . 0.0 109.879 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.645 ' HB ' HD23 ' A' ' 37' ' ' LEU . 33.3 t -121.51 132.33 70.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.656 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -142.5 175.95 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.895 0.379 . . . . 0.0 111.235 -172.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.451 HD21 ' N ' ' A' ' 30' ' ' ASN . 0.9 OUTLIER 63.48 46.98 4.03 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.414 175.087 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.478 HD12 HG13 ' A' ' 28' ' ' VAL . 0.3 OUTLIER -85.94 150.73 24.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.088 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.25 -47.26 16.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.319 0.58 . . . . 0.0 109.465 176.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.0 p -101.37 92.3 4.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.466 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -46.78 -73.81 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.926 -166.306 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -84.23 55.41 3.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.221 0.534 . . . . 0.0 111.391 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 m -145.26 36.99 1.12 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 122.047 0.927 . . . . 0.0 109.03 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.758 HD11 ' HD1' ' A' ' 89' ' ' HIS . 50.5 tp -108.44 153.16 23.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.137 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -135.77 148.67 48.87 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.515 HG22 ' HA3' ' A' ' 68' ' ' GLY . 14.2 mm -121.56 137.44 55.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.6 t -146.45 144.6 29.79 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.693 0.283 . . . . 0.0 110.741 -179.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.627 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 64.5 m95 -125.19 156.75 37.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.139 0.495 . . . . 0.0 111.443 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.39 155.1 29.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.505 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.3 m -80.04 157.54 26.72 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -53.51 -25.14 15.38 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.082 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.0 p -78.66 -2.15 37.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.55 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.47 22.06 48.89 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.776 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.433 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 42.6 mt-10 -99.55 123.82 46.69 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 25.1 Cg_exo -61.07 136.24 63.98 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.482 2.121 . . . . 0.0 112.097 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.402 ' HA ' HD21 ' A' ' 49' ' ' LEU . 9.1 mt -101.8 146.29 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.137 -178.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -68.17 105.74 2.19 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 175.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.43 HG23 HD12 ' A' ' 53' ' ' ILE . 6.3 m -118.14 114.38 22.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.524 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -114.93 122.03 45.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.152 0.501 . . . . 0.0 109.977 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.43 HD12 HG23 ' A' ' 51' ' ' THR . 4.7 mp -120.58 138.47 50.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.127 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -94.57 121.86 36.56 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.502 ' C ' ' H ' ' A' ' 57' ' ' GLU . 22.3 t 65.37 103.06 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 O-C-N 124.279 0.987 . . . . 0.0 108.964 -162.937 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 40.8 tpp -74.15 12.75 0.66 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.849 0.833 . . . . 0.0 110.568 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.502 ' H ' ' C ' ' A' ' 55' ' ' VAL . 27.6 mt-10 -120.72 157.24 30.08 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.069 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.466 ' HG ' ' HB3' ' A' ' 66' ' ' ALA . 16.3 m -74.97 150.93 38.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.116 0.484 . . . . 0.0 111.24 -167.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.617 ' HB3' ' OD1' ' A' ' 61' ' ' ASN . 73.4 m-70 -104.72 134.54 19.6 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.218 -167.381 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 97.5 Cg_endo -98.34 15.26 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.525 2.817 . . . . 0.0 112.708 175.327 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.617 ' OD1' ' HB3' ' A' ' 59' ' ' HIS . 27.8 p-10 -89.96 80.64 6.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.761 0.791 . . . . 0.0 111.234 -175.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.49 1.74 87.63 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.728 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.435 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 7.8 t -153.28 172.89 16.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -125.45 23.44 7.51 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m -126.13 172.26 10.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.936 -167.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.59 ' HB1' HD22 ' A' ' 37' ' ' LEU . . . -110.3 148.78 31.26 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.547 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 18.5 ptpt -132.64 141.22 48.54 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.339 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.515 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -128.27 128.95 6.12 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.781 178.284 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.9 t -109.83 127.04 66.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.908 0.385 . . . . 0.0 110.285 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.592 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.13 130.28 56.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.33 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.0 p -97.37 114.55 26.38 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.288 0.566 . . . . 0.0 111.007 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.552 HG21 ' HB1' ' A' ' 22' ' ' ALA . 17.9 m -119.8 167.15 13.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.083 -176.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.4 m -74.69 146.64 42.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.6 t -58.98 -33.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.45 0.643 . . . . 0.0 109.63 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.64 -33.57 71.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.722 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -63.5 -44.23 94.92 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.362 0.601 . . . . 0.0 109.653 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.455 ' NE1' ' HD3' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -74.29 -34.13 63.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.522 179.501 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -66.99 -25.16 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -95.35 7.38 46.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.703 177.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 54.49 37.79 28.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.5 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -63.97 158.46 22.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.137 0.494 . . . . 0.0 111.144 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 35.0 tt0 -109.32 139.53 44.15 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.632 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -123.07 156.83 34.11 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.095 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.423 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 98.7 t -125.54 126.04 69.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.489 -175.145 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.825 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.3 p -105.48 142.84 34.54 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.497 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -123.26 124.22 42.5 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.194 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.8 t -93.73 125.55 46.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 p -119.66 87.11 2.68 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.564 0.697 . . . . 0.0 111.061 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.758 ' HD1' HD11 ' A' ' 37' ' ' LEU . 10.1 t60 -98.42 -11.55 22.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.311 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.536 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 0.6 OUTLIER 71.14 -20.75 0.21 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.508 0.723 . . . . 0.0 111.28 -178.669 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.5 ' H ' ' C ' ' A' ' 89' ' ' HIS . 25.0 t70 -72.35 -36.29 68.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.987 0.422 . . . . 0.0 110.431 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.36 150.71 61.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.428 177.082 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 -20.15 15.23 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.93 2.42 . . . . 0.0 112.508 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 57.3 p -145.46 130.52 9.14 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.447 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.497 ' HB2' HG23 ' A' ' 86' ' ' THR . 15.4 Cg_endo -57.35 140.73 93.93 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.512 2.141 . . . . 0.0 111.561 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 -86.9 132.91 33.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 -177.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -107.93 135.83 48.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.575 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.825 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 65.9 mmtt -126.54 135.74 51.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.885 174.299 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.656 ' HD1' ' CD2' ' A' ' 99' ' ' PHE . 61.5 m-85 -101.46 129.97 47.61 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.734 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.451 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 13.9 tt -128.51 138.99 53.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.668 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.5 t -154.85 149.98 26.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.455 ' HD3' ' NE1' ' A' ' 77' ' ' TRP . 22.8 tptm . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.931 -177.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.482 1.147 0 CA-C-O 120.598 0.237 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -170.47 107.4 0.26 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.636 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 69.31 127.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 121.605 0.717 . . . . 0.0 111.304 -175.318 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.467 HG21 HD21 ' A' ' 31' ' ' LEU . 77.8 mt -68.93 122.76 20.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.974 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.0 mt -104.44 130.14 52.36 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.492 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 2.4 t -127.93 130.31 48.26 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.197 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -128.44 146.34 50.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.005 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.4 p -112.64 135.01 53.87 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.27 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.96 122.25 31.6 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.004 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.48 141.35 50.58 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.999 2.466 . . . . 0.0 111.967 177.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.54 ' HG2' HD12 ' A' ' 16' ' ' ILE . 58.4 Cg_endo -67.87 150.19 78.35 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.605 2.203 . . . . 0.0 111.424 177.538 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.464 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.0 t -78.88 131.23 36.35 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.71 -177.03 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.653 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 61.6 t80 -58.83 -34.01 71.06 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.114 -174.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.65 76.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.337 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.86 -38.08 87.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.055 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.54 HD12 ' HG2' ' A' ' 11' ' ' PRO . 75.1 mt -62.08 -36.82 76.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.355 176.275 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -72.38 -44.31 62.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.568 -178.002 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.4 mp -71.02 -48.28 53.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.586 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.3 m -79.67 -16.18 56.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.871 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 60.7 19.85 9.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.903 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.6 m -139.87 129.94 25.0 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.515 ' HB1' HG21 ' A' ' 72' ' ' VAL . . . -90.43 154.83 19.37 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.553 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -160.13 130.31 5.42 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.859 0.361 . . . . 0.0 110.733 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.593 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -84.22 138.29 33.04 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.992 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.4 m -120.62 127.04 51.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 -178.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.507 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 46.5 t -114.53 138.0 51.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.011 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -122.59 123.11 40.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.595 ' O ' ' HA ' ' A' ' 65' ' ' SER . 46.6 t -120.96 127.05 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.078 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.5 t -143.69 178.8 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.75 0.309 . . . . 0.0 111.235 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 60.02 33.58 21.36 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.314 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.668 HD12 HD23 ' A' ' 37' ' ' LEU . 56.3 mt -57.11 142.28 43.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.728 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.27 -50.11 13.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.432 178.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.503 HG23 ' OD2' ' A' ' 91' ' ' ASP . 15.1 t -107.74 168.06 9.53 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.265 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -108.94 8.81 26.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.885 0.374 . . . . 0.0 110.286 -178.003 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -76.53 91.33 3.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.462 -173.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.0 m 59.68 102.1 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 169.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.668 HD23 HD12 ' A' ' 31' ' ' LEU . 51.0 tp -103.21 145.42 29.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.74 -0.6 . . . . 0.0 110.173 174.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -134.05 150.49 51.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.925 -178.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.53 HG22 ' HA3' ' A' ' 68' ' ' GLY . 14.1 mm -121.25 136.69 57.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.5 t -138.99 153.19 48.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 73.9 m95 -134.51 146.99 50.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.383 0.611 . . . . 0.0 111.798 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.47 165.72 34.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.702 -1.136 . . . . 0.0 107.969 176.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.537 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 63.1 p -88.13 173.32 8.9 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.955 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.444 ' HB2' ' HB2' ' A' ' 82' ' ' GLU . 6.0 tp-100 -58.77 -34.97 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.401 0.62 . . . . 0.0 110.062 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.9 m -78.55 -5.7 53.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.806 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 11.71 59.38 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.225 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.537 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 7.1 pt-20 -76.38 131.75 74.22 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -178.498 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -64.43 138.28 59.4 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.282 1.988 . . . . 0.0 112.012 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.417 ' HA ' HD22 ' A' ' 49' ' ' LEU . 8.9 mt -120.16 136.07 54.75 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.463 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.92 107.58 7.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.233 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.9 m -93.97 132.22 38.64 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.525 -177.82 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.489 ' HB2' HG11 ' A' ' 69' ' ' VAL . 43.5 mttm -97.34 122.72 40.69 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 176.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.466 HD12 ' HB ' ' A' ' 39' ' ' ILE . 78.9 mt -129.56 118.58 45.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.729 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.411 ' C ' ' H ' ' A' ' 56' ' ' MET . 50.4 tptt -129.88 126.58 38.3 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.342 -0.844 . . . . 0.0 108.928 179.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.9 m -76.56 47.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.411 ' H ' ' C ' ' A' ' 54' ' ' LYS . 49.0 ttm -64.41 -33.68 76.43 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 170.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -151.52 132.6 14.35 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.02 169.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.8 p -126.05 140.89 52.23 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 169.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.775 ' HB3' ' HD2' ' A' ' 60' ' ' PRO . 28.4 m80 -89.52 161.6 39.01 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.72 -171.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.775 ' HD2' ' HB3' ' A' ' 59' ' ' HIS . 30.6 Cg_exo -13.18 138.24 0.0 OUTLIER 'Trans proline' 0 C--N 1.367 1.513 1 C-N-CA 127.988 5.792 . . . . 0.0 118.526 -166.565 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.7 m120 70.26 -160.8 0.15 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.986 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -52.01 -54.29 26.54 Favored Glycine 0 CA--C 1.505 -0.55 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 11.2 m -153.03 146.08 24.6 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 163.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.654 ' HE2' ' CE1' ' A' ' 64' ' ' PHE . 82.1 t80 -133.02 -30.3 1.37 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.723 ' HB2' ' HB2' ' A' ' 59' ' ' HIS . 11.1 m -145.01 150.83 37.58 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.674 173.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.49 ' HB2' HD12 ' A' ' 39' ' ' ILE . . . -141.49 162.43 35.51 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.065 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -130.27 140.75 50.66 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.53 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -138.39 127.62 3.87 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -124.97 133.27 69.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.09 0.472 . . . . 0.0 111.065 -173.512 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.553 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.73 134.51 55.04 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.663 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -96.77 119.11 34.64 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.126 0.489 . . . . 0.0 110.327 -174.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.515 HG21 ' HB1' ' A' ' 22' ' ' ALA . 20.0 m -126.35 166.28 22.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.269 -175.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.9 t -75.02 154.65 37.93 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.2 t -61.2 -33.47 56.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.553 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 13.2 mm-40 -62.57 -30.8 71.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.748 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.67 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 6.4 m-20 -59.7 -50.99 71.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.171 0.51 . . . . 0.0 109.652 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.518 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -63.11 -37.15 86.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.007 176.862 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.553 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 90.6 m-20 -69.49 -18.89 63.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.857 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -94.27 7.06 46.71 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.12 -0.363 . . . . 0.0 111.02 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 57.78 27.36 14.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.874 0.845 . . . . 0.0 109.525 -174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.67 ' HB3' ' O ' ' A' ' 76' ' ' ASP . 1.3 tppp? -68.5 142.64 55.23 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.188 -1.369 . . . . 0.0 109.963 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.444 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 58.1 mt-10 -105.99 143.93 33.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.929 0.395 . . . . 0.0 110.074 -178.431 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.474 ' HA ' ' HA ' ' A' ' 43' ' ' SER . 71.3 m-85 -121.62 154.86 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.839 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.658 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 67.1 t -127.68 133.76 66.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.18 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.431 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 39.9 t -105.28 132.65 51.21 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.2 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.471 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -114.87 119.7 37.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.331 176.913 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.99 126.91 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.967 -178.282 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.27 98.48 5.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.645 0.736 . . . . 0.0 110.907 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -99.36 -10.51 22.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.161 -177.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.453 ' O ' ' HD2' ' A' ' 90' ' ' ARG . 1.6 tmm_? 69.91 7.12 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 122.122 0.963 . . . . 0.0 108.85 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.503 ' OD2' HG23 ' A' ' 33' ' ' THR . 13.0 t70 -84.23 -33.73 24.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.287 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.73 152.56 65.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.073 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.85 -23.86 16.02 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.061 2.508 . . . . 0.0 112.961 -175.548 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.5 t -131.17 124.45 20.43 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 110.109 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.471 ' HB2' HG23 ' A' ' 86' ' ' THR . 27.8 Cg_endo -60.53 142.51 98.15 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 123.498 2.798 . . . . 0.0 112.848 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -81.99 141.41 33.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.908 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.468 ' HE3' HG12 ' A' ' 84' ' ' VAL . 30.6 mtpp -112.11 127.03 55.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 0.0 110.549 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.658 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 71.9 mmtt -117.64 140.05 50.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.51 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.42 ' CD1' HG23 ' A' ' 84' ' ' VAL . 72.8 m-85 -101.59 131.73 47.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.3 tt -121.94 138.14 53.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.249 0.547 . . . . 0.0 111.336 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.1 t -159.06 150.69 20.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.096 176.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.576 ' HE3' ' HB2' ' A' ' 13' ' ' PHE . 42.7 tttm . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.684 176.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.9 ptp . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.9 -91.18 0.89 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.262 -175.312 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 63.52 117.35 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.282 0.633 . . . . 0.0 110.693 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.701 HD13 ' HB3' ' A' ' 92' ' ' LEU . 44.9 mt -59.69 121.21 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.993 0.425 . . . . 0.0 111.155 -172.495 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.2 mt -117.53 132.18 56.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.322 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.32 127.3 53.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.815 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -115.96 130.39 56.8 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.532 ' HB ' HD13 ' A' ' 100' ' ' ILE . 11.2 p -115.9 136.46 53.02 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.014 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.423 HD13 ' N ' ' A' ' 9' ' ' ILE . 4.1 mp -116.54 119.21 36.28 Favored Pre-proline 0 N--CA 1.442 -0.844 0 CA-C-O 121.069 0.461 . . . . 0.0 110.042 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.412 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 61.1 Cg_endo -71.59 138.98 33.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.554 2.169 . . . . 0.0 111.065 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.43 ' HD2' ' CE2' ' A' ' 77' ' ' TRP . 54.6 Cg_endo -66.97 151.8 81.46 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.593 2.195 . . . . 0.0 111.711 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.48 ' O ' HG13 ' A' ' 16' ' ' ILE . 20.7 t -82.01 137.42 35.1 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.619 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 24.4 t80 -57.88 -30.48 65.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.911 -174.812 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.593 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -69.09 -46.07 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.565 176.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.55 -39.81 94.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.497 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.52 HD13 ' HA ' ' A' ' 13' ' ' PHE . 72.1 mt -59.48 -37.51 70.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.577 176.157 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.651 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 61.6 t80 -68.72 -42.39 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.361 -178.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.593 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.2 mt -61.92 -40.15 94.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.811 -177.609 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.448 ' C ' ' H ' ' A' ' 21' ' ' SER . 25.9 t -88.3 -13.71 40.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.051 -179.206 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.418 ' HB3' ' O ' ' A' ' 19' ' ' SER . 86.0 tttt 70.88 -8.47 0.95 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.711 0.767 . . . . 0.0 110.618 -174.102 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.448 ' H ' ' C ' ' A' ' 19' ' ' SER . 20.0 m -132.41 144.57 50.6 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.268 -178.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.834 ' HB1' ' HB ' ' A' ' 72' ' ' VAL . . . -78.54 175.42 10.37 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.543 ' HA ' HG21 ' A' ' 72' ' ' VAL . 9.9 p30 -160.12 138.05 9.93 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -177.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.686 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 31.9 mt -105.97 125.65 51.24 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.01 -176.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.3 m -109.0 127.32 53.98 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.999 0.428 . . . . 0.0 110.54 -177.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.608 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.4 t -118.26 137.13 53.25 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.976 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.15 122.68 32.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.512 ' HB ' HD22 ' A' ' 37' ' ' LEU . 39.2 t -116.08 128.37 73.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.0 p -142.26 177.31 8.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.78 0.324 . . . . 0.0 111.365 -174.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 59.79 38.36 21.53 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.723 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.774 HD12 HD23 ' A' ' 37' ' ' LEU . 69.8 mt -66.49 131.65 46.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.759 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.415 ' HB1' ' OD2' ' A' ' 91' ' ' ASP . . . -69.45 -49.85 51.11 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.579 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.667 HG23 ' HB2' ' A' ' 91' ' ' ASP . 2.7 t -100.29 157.33 16.68 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 172.036 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.64 ' HE2' ' CE1' ' A' ' 34' ' ' TYR . 56.2 m-85 -102.57 34.11 2.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.178 0.513 . . . . 0.0 110.922 -174.091 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.522 ' H ' HG21 ' A' ' 33' ' ' THR . 10.6 tp10 -74.91 167.96 20.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.608 175.299 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 m -54.1 141.35 29.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.205 0.526 . . . . 0.0 111.062 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.774 HD23 HD12 ' A' ' 31' ' ' LEU . 35.8 tp -114.03 151.97 31.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.2 178.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -137.0 153.63 50.62 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.547 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -121.05 136.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.1 t -135.48 135.78 40.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.721 0.296 . . . . 0.0 110.271 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.608 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 68.8 m95 -123.24 139.0 54.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.093 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.77 160.14 42.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.741 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 79.0 p -87.65 161.53 17.63 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.18 176.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.68 -21.42 66.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.059 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.4 p -76.46 -8.46 57.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.811 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.67 22.44 31.16 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.767 -0.73 . . . . 0.0 113.036 176.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -94.47 121.96 62.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.26 135.3 53.42 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.055 1.836 . . . . 0.0 110.516 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.404 HD21 ' HA ' ' A' ' 49' ' ' LEU . 2.2 mt -108.31 139.79 42.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.367 0.604 . . . . 0.0 111.885 -171.992 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.487 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 3.6 tm-20 -57.22 116.51 3.32 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.386 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 m -121.75 128.08 51.36 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 -175.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -110.19 136.08 49.96 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.466 HD12 ' HB ' ' A' ' 39' ' ' ILE . 97.8 mt -129.99 118.73 45.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.069 0.461 . . . . 0.0 109.978 176.756 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -129.67 110.21 11.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.294 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.0 p -91.25 87.18 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.838 0.827 . . . . 0.0 111.661 -174.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 88.4 mmm -85.91 -33.6 21.16 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 168.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -142.86 130.91 21.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.615 174.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.3 p -134.3 166.62 22.38 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.432 178.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.694 ' HB3' ' HB3' ' A' ' 64' ' ' PHE . 14.0 m-70 -96.68 131.19 28.62 Favored Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 119.391 -0.923 . . . . 0.0 109.346 167.455 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.515 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 93.1 Cg_endo -87.35 -134.01 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.129 2.553 . . . . 0.0 115.602 -164.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.515 ' HB2' ' O ' ' A' ' 60' ' ' PRO . 13.2 m120 73.23 -79.01 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.919 0.888 . . . . 0.0 109.169 -164.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.463 ' HA3' ' O ' ' A' ' 34' ' ' TYR . . . -133.89 -59.27 0.07 OUTLIER Glycine 0 CA--C 1.498 -1.003 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 166.463 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.613 HG22 ' HB3' ' A' ' 37' ' ' LEU . 5.3 m -149.28 147.42 28.35 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.448 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.694 ' HB3' ' HB3' ' A' ' 59' ' ' HIS . 63.6 t80 -133.37 -28.76 1.45 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.486 0.66 . . . . 0.0 109.361 175.417 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.503 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 19.3 m -149.48 151.06 33.31 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.86 174.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -143.03 163.92 31.49 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.73 -172.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -127.89 137.99 52.51 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 176.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.547 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -147.02 131.57 4.01 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.686 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.5 p -129.42 137.93 55.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.68 0.276 . . . . 0.0 110.899 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.489 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.5 151.48 33.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.5 -177.177 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 26.3 m -98.0 114.16 26.21 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 122.38 1.086 . . . . 0.0 110.89 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.834 ' HB ' ' HB1' ' A' ' 22' ' ' ALA . 1.7 t -116.93 167.83 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.526 -172.913 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.419 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 19.0 m -100.13 139.97 35.03 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 175.422 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.9 p -54.32 -36.61 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-O 121.174 0.512 . . . . 0.0 110.475 177.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -56.41 -36.55 69.06 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.888 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.537 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 44.3 m-20 -67.26 -48.84 66.52 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.297 0.57 . . . . 0.0 109.938 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.43 ' CE2' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -69.12 -34.56 75.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.264 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.5 t-20 -66.14 -22.03 66.36 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.241 179.693 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -102.12 10.66 39.29 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.128 177.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.402 HH11 ' HD2' ' A' ' 80' ' ' ARG . 13.4 mmt180 58.78 36.71 24.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.306 178.791 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.537 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 61.9 mtpt -74.26 164.25 26.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.991 0.424 . . . . 0.0 110.753 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.82 148.98 42.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.812 -176.076 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.643 ' HD2' ' CD1' ' A' ' 83' ' ' PHE . 93.7 m-85 -130.64 162.06 30.22 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.222 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.4 t -119.58 129.51 75.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.333 0.587 . . . . 0.0 110.953 -177.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.413 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 37.7 t -105.45 140.31 38.74 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 173.108 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.419 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 m -126.2 132.79 51.7 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.7 t -112.6 125.69 69.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.092 0.472 . . . . 0.0 111.08 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -107.6 85.76 2.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.616 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.511 ' HB3' HD21 ' A' ' 92' ' ' LEU . 3.5 t60 -98.8 -16.84 18.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.898 -176.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 70.89 -22.09 0.19 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.102 0.561 . . . . 0.0 111.408 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.667 ' HB2' HG23 ' A' ' 33' ' ' THR . 14.5 t0 -72.26 -37.04 69.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.661 0.743 . . . . 0.0 110.767 -178.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.701 ' HB3' HD13 ' A' ' 4' ' ' ILE . 1.4 pt? -89.55 147.66 38.42 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.057 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -50.41 -32.91 35.75 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.506 2.137 . . . . 0.0 112.717 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.452 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 31.5 m -155.93 154.8 28.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -51.74 139.44 48.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.463 2.108 . . . . 0.0 112.062 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.419 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.8 pt20 -94.85 141.89 28.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.453 -177.85 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -107.73 127.59 53.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.138 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -120.23 132.89 55.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.624 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.622 ' HD2' ' CD1' ' A' ' 99' ' ' PHE . 94.7 m-85 -100.36 135.72 41.36 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -177.581 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.532 HD13 ' HB ' ' A' ' 8' ' ' THR . 11.9 tt -126.6 137.45 57.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.8 p -158.61 149.55 20.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.248 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.008 179.463 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.533 ' O ' ' HB3' ' A' ' 32' ' ' ALA . . . 90.92 16.13 55.0 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.295 -175.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.19 128.95 34.67 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.802 0.441 . . . . 0.0 110.701 -178.647 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.466 HG21 HD21 ' A' ' 31' ' ' LEU . 64.9 mt -60.2 123.68 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.688 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 65.7 mt -111.78 131.49 55.29 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.053 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.2 t -117.42 130.58 56.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.588 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.9 135.4 51.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.335 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -113.36 132.78 55.47 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.836 0.35 . . . . 0.0 110.754 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -117.62 124.25 29.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.653 -174.792 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.41 139.45 49.52 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.692 2.262 . . . . 0.0 111.583 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -67.18 156.09 67.81 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.993 2.462 . . . . 0.0 112.741 -178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.461 ' O ' HG13 ' A' ' 16' ' ' ILE . 43.9 t -84.17 137.56 33.45 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.493 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.666 ' HD1' ' CD2' ' A' ' 13' ' ' PHE . 93.8 m-85 -61.37 -42.42 98.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.469 -175.605 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.96 -35.58 81.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.984 0.421 . . . . 0.0 110.444 177.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -68.02 -44.25 76.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.326 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 12' ' ' SER . 81.1 mt -59.75 -36.8 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.627 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.648 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 44.4 t80 -72.3 -44.09 63.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.517 -177.001 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.92 -48.07 75.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.504 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 t -75.15 -21.41 58.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttm 69.4 7.05 6.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.695 0.759 . . . . 0.0 110.309 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.5 t -138.49 142.1 39.39 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.508 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -88.8 144.38 26.27 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.549 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -130.39 120.36 24.15 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.495 0.664 . . . . 0.0 110.821 -174.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.674 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.8 mt -78.1 129.72 35.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.233 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.2 m -116.24 126.17 53.24 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.283 0.563 . . . . 0.0 111.107 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.0 t -127.17 137.0 52.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.149 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.41 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.13 137.05 48.86 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.642 177.045 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.94 HG22 HD22 ' A' ' 37' ' ' LEU . 11.8 m -117.65 145.3 23.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -142.36 176.43 9.0 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 58.32 48.77 11.99 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.544 0.527 . . . . 0.0 112.068 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.466 HD21 HG21 ' A' ' 4' ' ' ILE . 26.2 mt -82.11 117.03 21.96 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.533 ' HB3' ' O ' ' A' ' 2' ' ' GLY . . . -59.19 -43.38 92.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.399 0.619 . . . . 0.0 110.685 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 t -105.16 145.13 31.0 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.242 172.612 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.631 ' HE1' ' CE2' ' A' ' 34' ' ' TYR . 73.2 m-85 -113.09 45.57 1.35 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.285 0.564 . . . . 0.0 110.97 179.208 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.4 ' HB3' ' H ' ' A' ' 36' ' ' THR . 59.9 mt-10 -92.09 -160.31 0.73 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.266 173.251 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.4 ' H ' ' HB3' ' A' ' 35' ' ' GLU . 25.0 m -52.06 126.23 17.89 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.591 177.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.94 HD22 HG22 ' A' ' 28' ' ' VAL . 34.0 tp -126.27 149.44 49.1 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.61 174.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -135.03 150.38 50.29 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.976 -177.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.507 HG22 ' HA3' ' A' ' 68' ' ' GLY . 21.8 mm -120.5 136.32 57.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 176.29 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.4 m -128.36 126.59 41.0 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.29 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.413 ' HB2' ' OG1' ' A' ' 51' ' ' THR . 67.8 m95 -108.29 137.84 45.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.794 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.03 165.15 34.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.175 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.682 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 24.1 t -79.61 173.27 12.76 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 173.765 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.5 ' HA ' HG21 ' A' ' 84' ' ' VAL . 52.7 tt0 -53.3 -33.67 54.22 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.15 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.4 t -77.52 -7.74 56.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.801 0.334 . . . . 0.0 111.473 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.16 30.44 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.554 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.682 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 9.9 pt-20 -89.2 124.85 63.79 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.34 142.59 94.96 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.712 2.941 . . . . 0.0 114.489 -168.153 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.411 HD21 ' HA ' ' A' ' 49' ' ' LEU . 9.3 mt -120.47 147.39 45.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.524 175.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 23.1 mm-40 -63.26 106.63 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.319 0.58 . . . . 0.0 111.059 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.413 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 18.5 m -113.13 130.94 56.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.915 -177.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -103.37 120.0 39.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.747 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 71.9 mt -134.98 119.51 27.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.356 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -108.67 142.8 38.63 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.57 HG13 ' H ' ' A' ' 57' ' ' GLU . 54.2 t 68.34 117.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 123.837 0.711 . . . . 0.0 110.175 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptp -75.75 7.91 3.45 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.194 0.521 . . . . 0.0 111.519 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.57 ' H ' HG13 ' A' ' 55' ' ' VAL . 49.4 mt-10 -125.05 159.19 31.94 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 p -73.18 148.0 44.21 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.41 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 37.0 m170 -91.3 128.91 45.28 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.135 -163.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.53 ' HA ' ' O ' ' A' ' 63' ' ' THR . 78.7 Cg_endo -97.18 -174.11 0.21 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.527 2.818 . . . . 0.0 112.946 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 63.46 91.11 0.07 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.157 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.99 -37.65 3.36 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.688 HG23 ' H ' ' A' ' 65' ' ' SER . 15.8 m -133.37 160.46 37.28 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -131.47 23.86 4.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.765 0.793 . . . . 0.0 109.453 173.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.688 ' H ' HG23 ' A' ' 63' ' ' THR . 19.3 m -112.65 167.98 10.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.927 -169.233 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.6 ' HB1' HG23 ' A' ' 28' ' ' VAL . . . -108.38 155.25 20.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 172.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -130.6 141.37 50.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.108 0.48 . . . . 0.0 110.391 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.507 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -136.56 123.09 2.79 Favored Glycine 0 N--CA 1.437 -1.288 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.674 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.7 p -125.48 131.37 72.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 120.959 0.409 . . . . 0.0 111.187 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.549 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.33 142.47 46.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.294 -177.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 m -98.63 114.03 26.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.508 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.1 m -123.01 165.97 18.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.6 t -78.02 151.81 33.35 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.2 -29.26 46.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 4.3 mm-40 -66.29 -32.71 74.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.413 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -60.39 -45.4 93.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.352 0.596 . . . . 0.0 109.512 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.564 ' CD1' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -72.04 -35.0 69.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.431 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.497 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 72.1 m-20 -67.03 -32.77 74.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.373 178.016 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -95.34 11.67 31.84 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? 63.38 38.67 9.94 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.293 0.371 . . . . 0.0 111.986 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -66.03 154.7 38.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -119.92 139.79 51.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.211 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.635 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 78.9 m-85 -128.29 160.64 31.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.609 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.538 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 69.5 t -125.23 125.17 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.337 -178.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.404 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 33.9 t -105.76 132.28 52.07 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.554 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -121.14 134.0 55.22 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -179.292 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.42 125.9 72.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.846 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -123.12 105.64 10.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.193 0.521 . . . . 0.0 110.451 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.545 ' CG ' HD11 ' A' ' 37' ' ' LEU . 1.1 t60 -101.02 -10.53 20.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.086 -177.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.622 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 1.0 OUTLIER 74.1 -0.7 3.28 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 0.0 109.417 -170.973 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.424 ' CB ' HD12 ' A' ' 4' ' ' ILE . 24.0 t0 -72.56 -36.62 68.27 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.156 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.19 154.23 58.47 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.372 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -75.16 -21.86 15.14 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.956 2.437 . . . . 0.0 112.779 -177.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.1 m -130.1 119.58 18.84 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.106 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.554 ' HB2' HG23 ' A' ' 86' ' ' THR . 50.6 Cg_endo -69.1 143.24 53.32 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.866 2.377 . . . . 0.0 112.725 -177.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -81.2 142.0 33.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.562 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.404 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 19.7 ptpt -116.53 143.08 46.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.023 0.439 . . . . 0.0 111.059 179.529 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.538 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 48.1 mmtt -122.01 140.83 52.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.608 178.42 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -101.14 146.33 27.61 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 tt -144.9 137.72 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.007 -0.677 . . . . 0.0 112.43 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 p -159.21 142.9 14.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.564 ' HD3' ' CD1' ' A' ' 77' ' ' TRP . 20.8 pttp . . . . . 0 C--O 1.247 0.953 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.444 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.688 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 19.6 ptp . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 99.57 -176.6 28.9 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.768 -0.729 . . . . 0.0 111.772 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -82.69 125.55 31.36 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.504 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.3 mt -60.2 121.78 8.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.636 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.9 mt -104.15 131.02 51.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.115 0.484 . . . . 0.0 111.413 -176.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -121.59 119.45 31.94 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.648 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.663 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 79.7 m-85 -116.29 132.27 56.71 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 6.6 p -112.45 131.02 55.78 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.234 0.54 . . . . 0.0 110.701 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.9 mm -117.74 123.96 29.26 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.785 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.524 ' HA ' HD12 ' A' ' 100' ' ' ILE . 43.5 Cg_endo -67.33 139.22 49.1 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.203 1.935 . . . . 0.0 110.391 173.728 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.525 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 56.5 Cg_endo -63.77 132.38 34.78 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.053 1.836 . . . . 0.0 110.658 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.476 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 15.4 t -78.5 145.39 34.97 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.852 -176.641 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -59.57 -29.39 67.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.323 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.42 ' O ' HD11 ' A' ' 18' ' ' LEU . . . -65.53 -46.45 79.54 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 174.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.476 ' OD2' ' HB3' ' A' ' 12' ' ' SER . 31.0 m-20 -64.96 -43.6 92.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.607 -179.381 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.5 mt -58.32 -34.65 50.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.581 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.654 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 59.1 t80 -72.14 -42.39 66.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.879 -178.508 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.42 HD11 ' O ' ' A' ' 14' ' ' ALA . 6.9 mp -59.9 -48.84 80.06 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.198 -176.972 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 p -94.6 -10.61 31.46 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 64.54 18.83 11.57 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.3 0.571 . . . . 0.0 110.884 -178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.6 t -139.02 144.94 39.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.116 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.42 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -87.16 134.93 33.47 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.659 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 39.1 m-80 -137.0 116.82 13.1 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.151 -174.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.508 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -73.34 146.01 45.55 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.86 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.5 m -125.27 124.89 42.63 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.683 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.675 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 38.1 t -117.23 134.27 54.99 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.932 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -114.76 123.54 49.5 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.93 128.64 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.821 0.343 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.48 ' HA ' ' HB3' ' A' ' 58' ' ' SER . 68.6 m -144.02 172.29 13.08 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.822 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 60.27 52.19 5.05 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.893 0.746 . . . . 0.0 112.473 171.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.724 HD12 HD23 ' A' ' 37' ' ' LEU . 30.9 mt -75.87 153.43 36.78 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.16 177.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.688 ' HA ' ' HA ' ' A' ' 1' ' ' MET . . . -89.45 -50.64 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.53 0.205 . . . . 0.0 111.236 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.2 p -88.14 156.12 19.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.671 0.272 . . . . 0.0 110.958 177.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -90.78 16.21 9.71 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.807 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.561 ' O ' ' HE1' ' A' ' 89' ' ' HIS . 63.3 mm-40 -69.59 169.97 11.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.612 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.3 m -67.59 144.46 55.57 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.219 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.724 HD23 HD12 ' A' ' 31' ' ' LEU . 58.9 tp -105.03 145.98 29.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.133 0.492 . . . . 0.0 110.683 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -128.41 148.95 50.73 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.082 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.525 ' HB ' HG12 ' A' ' 53' ' ' ILE . 21.5 mm -120.06 135.14 61.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.315 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.8 m -124.72 135.01 52.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.828 0.347 . . . . 0.0 110.832 -178.332 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.438 ' CH2' ' HB2' ' A' ' 85' ' ' CYS . 66.2 m95 -125.83 138.01 53.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.104 174.204 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.74 158.19 41.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.669 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 t -78.54 160.56 27.57 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -55.54 -32.0 62.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.089 0.471 . . . . 0.0 111.086 -179.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.03 -4.77 43.13 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.425 -178.036 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.04 22.97 28.71 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.394 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -92.37 122.12 65.17 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -64.78 144.09 82.43 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.772 2.315 . . . . 0.0 112.786 -177.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 5.7 mt -120.4 146.39 46.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.41 0.624 . . . . 0.0 111.783 -178.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.33 118.2 11.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.936 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.535 HG23 HD12 ' A' ' 53' ' ' ILE . 1.8 m -143.72 130.83 20.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.096 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -117.66 120.98 39.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 110.713 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.535 HD12 HG23 ' A' ' 51' ' ' THR . 4.0 mp -136.06 138.44 47.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.661 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -126.99 124.2 38.89 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.52 166.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.584 HG12 ' HB3' ' A' ' 66' ' ' ALA . 6.2 p -173.77 135.91 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 121.085 0.469 . . . . 0.0 111.231 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 50.7 tpp -108.06 -51.11 2.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.898 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -122.82 155.35 36.76 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.631 ' HA ' ' HA ' ' A' ' 65' ' ' SER . 63.0 m -123.28 133.95 54.13 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.395 0.617 . . . . 0.0 112.21 -178.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.584 ' O ' ' HB ' ' A' ' 63' ' ' THR . 11.1 m80 -149.77 130.23 6.9 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.907 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.474 ' HD3' ' HB3' ' A' ' 29' ' ' SER . 63.0 Cg_endo -73.64 174.67 11.85 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.18 1.92 . . . . 0.0 114.438 -168.168 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.432 ' CG ' ' H ' ' A' ' 62' ' ' GLY . 60.1 t30 77.02 -152.55 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.951 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . 0.432 ' H ' ' CG ' ' A' ' 61' ' ' ASN . . . -74.15 60.58 2.26 Favored Glycine 0 C--N 1.335 0.513 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 176.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.584 ' HB ' ' O ' ' A' ' 59' ' ' HIS . 4.5 m -142.11 177.23 8.37 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -168.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.613 ' HD1' ' CD2' ' A' ' 64' ' ' PHE . 6.7 t80 -78.55 35.23 0.23 Allowed 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 124.725 1.21 . . . . 0.0 113.952 -162.173 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.631 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 21.1 p -95.49 172.85 7.82 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.126 -0.984 . . . . 0.0 109.24 -172.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.584 ' HB3' HG12 ' A' ' 55' ' ' VAL . . . -103.21 143.37 32.72 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.478 0.656 . . . . 0.0 111.974 -163.209 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.675 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 97.8 mttt -130.18 139.09 50.88 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.919 177.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.512 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -119.94 115.52 3.01 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.211 176.439 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.508 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -108.2 120.74 60.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.849 0.357 . . . . 0.0 110.209 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.659 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.97 132.45 56.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.905 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.0 m -98.0 118.95 35.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.191 0.52 . . . . 0.0 110.829 -174.684 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.42 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.4 m -124.43 167.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.152 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.6 t -78.21 149.34 33.69 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -65.48 -27.28 41.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.802 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.12 -35.66 81.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.943 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -65.02 -42.23 94.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.522 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -73.8 -36.52 65.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.431 179.214 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 -73.16 -21.15 60.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.913 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -94.96 7.08 47.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.953 0.406 . . . . 0.0 110.209 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.5 ttp180 54.75 39.43 31.36 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.195 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -65.1 164.78 12.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.339 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -108.73 139.2 43.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.616 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.522 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 68.3 m-85 -124.77 148.9 47.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.723 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.441 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.1 t -117.6 127.17 75.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.842 -174.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.438 ' HB2' ' CH2' ' A' ' 41' ' ' TRP . 43.8 t -105.44 136.68 44.56 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.499 HG21 ' HG2' ' A' ' 97' ' ' LYS . 1.0 OUTLIER -125.93 130.0 50.42 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 178.465 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.75 124.08 54.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.523 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.28 92.48 3.7 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.74 0.781 . . . . 0.0 110.395 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.561 ' HE1' ' O ' ' A' ' 35' ' ' GLU . 10.6 t60 -97.9 -9.22 26.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.294 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.33 17.66 11.07 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.542 -174.207 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -82.99 -27.89 30.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.001 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.52 153.87 77.97 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.177 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.23 -22.78 12.43 Favored 'Trans proline' 0 N--CA 1.465 -0.185 0 C-N-CA 123.076 2.517 . . . . 0.0 112.329 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 10.6 p -113.82 105.69 54.35 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.432 177.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.482 ' HB2' HG23 ' A' ' 86' ' ' THR . 30.9 Cg_endo -64.14 141.49 76.47 Favored 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.573 2.182 . . . . 0.0 111.738 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -83.73 128.0 34.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.396 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.499 ' HG2' HG21 ' A' ' 86' ' ' THR . 49.7 mtmt -106.88 139.33 41.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.385 0.612 . . . . 0.0 111.074 178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 42.2 mmtt -118.15 130.71 56.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.686 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.608 ' HE2' ' CE1' ' A' ' 99' ' ' PHE . 93.6 m-85 -101.45 121.87 42.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.947 179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.524 HD12 ' HA ' ' A' ' 10' ' ' PRO . 14.0 tt -123.79 139.22 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.114 0.483 . . . . 0.0 110.656 -178.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.1 t -158.1 150.65 22.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.218 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 37.2 ttpt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.799 179.229 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptt? . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.932 0.396 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -100.24 28.46 15.66 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.313 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -127.27 144.32 51.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.352 -0.424 . . . . 0.0 109.922 -176.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.518 HG12 ' HA ' ' A' ' 31' ' ' LEU . 76.1 mt -61.37 126.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.571 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.2 mt -104.69 129.74 52.83 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.228 0.537 . . . . 0.0 110.022 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.555 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.2 t -125.24 127.86 47.4 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.72 -179.038 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -123.91 142.06 51.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' THR . . . . . 0.414 ' HB ' HD13 ' A' ' 100' ' ' ILE . 16.8 p -113.6 135.0 54.39 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.523 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.14 121.9 31.87 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.1 138.89 34.52 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.665 2.243 . . . . 0.0 111.682 177.403 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.416 ' HG2' HD12 ' A' ' 16' ' ' ILE . 58.5 Cg_endo -68.62 146.88 68.71 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.467 2.111 . . . . 0.0 111.523 178.156 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 m -83.14 142.6 31.11 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.118 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.658 ' HE2' ' CE1' ' A' ' 13' ' ' PHE . 69.8 t80 -54.02 -43.77 70.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -172.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.648 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.88 -40.64 95.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.945 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.21 -39.38 93.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.09 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.416 HD12 ' HG2' ' A' ' 11' ' ' PRO . 71.6 mt -64.55 -32.89 59.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.602 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.66 ' HE2' ' CE1' ' A' ' 17' ' ' PHE . 26.0 t80 -71.59 -37.05 71.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.327 -177.971 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.648 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 24.2 mt -67.41 -42.68 82.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.852 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.8 p -85.94 -21.28 27.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.427 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.9 mmtp 66.97 6.19 4.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.213 -175.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.2 p -138.62 125.62 21.25 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.505 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -70.34 138.26 51.28 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.478 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.6 p30 -117.27 128.4 55.03 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.229 0.538 . . . . 0.0 110.227 -177.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.692 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 77.7 mt -91.22 122.63 34.01 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.635 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 56.5 m -111.19 123.82 50.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.266 0.555 . . . . 0.0 111.081 -176.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.469 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.1 t -117.89 137.21 52.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.559 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -121.56 123.58 42.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.549 HG12 HG12 ' A' ' 87' ' ' VAL . 22.5 t -117.25 120.6 65.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 p -136.08 176.56 8.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.005 -173.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.403 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 12.7 m120 56.98 50.6 11.89 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.763 0.664 . . . . 0.0 111.769 175.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.627 HD12 HD23 ' A' ' 37' ' ' LEU . 39.0 mt -74.5 128.91 36.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.683 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.81 -49.94 64.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.292 -176.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.427 HG23 ' OD2' ' A' ' 91' ' ' ASP . 5.8 t -113.15 147.61 37.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 173.588 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.664 ' HD2' ' CD1' ' A' ' 34' ' ' TYR . 81.5 t80 -93.95 132.21 38.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.353 0.596 . . . . 0.0 111.926 -176.507 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.797 ' HG2' ' H ' ' A' ' 36' ' ' THR . 35.3 tt0 -171.72 -171.5 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.797 ' H ' ' HG2' ' A' ' 35' ' ' GLU . 7.9 t -60.62 153.51 23.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 110.579 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.627 HD23 HD12 ' A' ' 31' ' ' LEU . 43.6 tp -136.93 148.65 47.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.86 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -137.9 155.07 49.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.513 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.494 HG23 HG22 ' A' ' 51' ' ' THR . 3.0 mp -120.76 135.34 61.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 174.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.3 m -129.6 122.86 29.94 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.658 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.606 ' HD1' HG21 ' A' ' 51' ' ' THR . 79.7 m95 -106.11 136.94 44.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.165 0.507 . . . . 0.0 110.829 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.56 141.0 18.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.87 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.516 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 44.6 t -70.57 151.3 45.18 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 175.636 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -64.57 -21.25 66.65 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.693 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.9 m -75.42 -4.72 41.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.108 178.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.68 23.16 26.66 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.852 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 23.7 mt-10 -95.46 120.77 63.2 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -178.133 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 11.8 Cg_exo -70.63 141.99 43.0 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.238 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.425 HD21 ' HA ' ' A' ' 49' ' ' LEU . 9.5 mt -126.53 141.5 51.85 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.103 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -80.67 107.25 13.32 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.356 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.606 HG21 ' HD1' ' A' ' 41' ' ' TRP . 9.6 m -97.3 132.46 43.02 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.489 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -111.47 123.02 49.35 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.349 -178.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.431 HG13 ' HA2' ' A' ' 68' ' ' GLY . 4.8 mp -128.19 125.57 64.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 174.952 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -96.01 138.95 32.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.458 HG13 ' H ' ' A' ' 57' ' ' GLU . 58.9 t 71.6 116.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.099 -167.241 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.9 mmm -75.95 9.2 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.422 0.63 . . . . 0.0 111.328 -174.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.458 ' H ' HG13 ' A' ' 55' ' ' VAL . 48.4 mt-10 -129.11 158.01 40.15 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.523 -178.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 t -74.48 151.77 39.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.461 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 10.7 m170 -91.08 128.09 48.98 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.286 -166.229 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.5 ' HB2' ' H ' ' A' ' 61' ' ' ASN . 88.4 Cg_endo -100.13 -141.57 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.612 2.875 . . . . 0.0 114.258 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.5 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 49.1 m-80 76.08 -89.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.056 0.942 . . . . 0.0 110.379 -176.381 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.59 8.4 19.86 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 174.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.648 HG23 ' H ' ' A' ' 65' ' ' SER . 4.9 m -124.62 157.5 35.35 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.565 -0.818 . . . . 0.0 109.814 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.66 ' HD1' ' CD2' ' A' ' 64' ' ' PHE . 84.0 m-85 -132.35 22.64 4.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 172.644 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.648 ' H ' HG23 ' A' ' 63' ' ' THR . 7.1 m -118.64 154.82 32.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.764 -163.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.455 ' HB2' HD12 ' A' ' 39' ' ' ILE . . . -115.15 160.56 19.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.936 174.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -130.46 140.93 50.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.431 ' HA2' HG13 ' A' ' 53' ' ' ILE . . . -141.01 124.11 2.48 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.692 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.4 p -119.0 135.98 57.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-O 121.011 0.434 . . . . 0.0 111.354 -174.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.478 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.9 147.87 40.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.708 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.8 m -99.44 114.34 27.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.839 0.352 . . . . 0.0 110.195 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.505 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 1.8 m -122.34 166.88 16.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.17 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.5 m -86.02 145.52 27.05 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.4 t -60.06 -33.57 53.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 CA-C-O 121.676 0.751 . . . . 0.0 109.517 -178.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.474 ' CD ' ' H ' ' A' ' 75' ' ' GLU . 1.8 mp0 -57.1 -37.44 71.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.893 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -62.34 -42.37 99.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.724 0.773 . . . . 0.0 109.015 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.54 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -69.87 -41.01 75.37 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.347 178.849 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -71.96 -21.79 61.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.481 -178.432 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -97.53 9.12 43.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.58 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 58.51 36.86 25.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.643 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -71.34 162.8 28.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.81 0.338 . . . . 0.0 110.8 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.652 ' HA ' ' HG ' ' A' ' 101' ' ' SER . 56.4 mp0 -106.98 137.8 44.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.188 0.518 . . . . 0.0 110.575 -177.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.54 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 76.1 m-85 -125.31 146.34 49.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.692 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.547 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 99.5 t -121.17 129.02 76.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.808 -176.272 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.747 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.2 p -107.11 123.28 48.0 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.626 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.524 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -112.17 131.1 55.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.107 -178.812 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.549 HG12 HG12 ' A' ' 28' ' ' VAL . 40.2 t -105.46 127.33 60.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.989 -176.173 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.8 p -120.46 90.6 3.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.515 0.674 . . . . 0.0 110.669 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.539 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 11.3 t60 -99.44 -10.17 22.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.658 -175.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.511 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 8.2 tpt180 74.04 0.68 3.68 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.158 0.98 . . . . 0.0 109.853 -174.034 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.539 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.76 -36.4 65.09 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.286 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.34 154.84 80.71 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.701 -177.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.17 -31.37 12.07 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.929 2.419 . . . . 0.0 112.434 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 21.0 m -112.63 109.17 53.46 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.642 -179.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.524 ' HB2' HG23 ' A' ' 86' ' ' THR . 17.8 Cg_endo -59.68 140.27 92.75 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.569 2.179 . . . . 0.0 111.789 -178.468 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.2 143.49 31.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.452 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -128.59 144.07 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.439 -177.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.747 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 69.6 mmtt -126.28 146.59 49.95 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.197 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.26 129.69 55.5 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.414 HD13 ' HB ' ' A' ' 8' ' ' THR . 15.0 tt -131.31 138.73 52.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.84 0.352 . . . . 0.0 110.57 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.652 ' HG ' ' HA ' ' A' ' 82' ' ' GLU . 50.3 m -157.14 150.41 23.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.776 -177.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.423 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 22.2 tptm . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.661 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.07 55.29 0.99 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.967 178.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -98.03 113.2 25.0 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.661 0.267 . . . . 0.0 110.428 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.627 HG21 HD21 ' A' ' 31' ' ' LEU . 93.8 mt -84.3 125.63 40.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 174.04 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . 0.457 HD21 ' HB2' ' A' ' 30' ' ' ASN . 1.5 mm? -100.81 130.52 46.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.183 0.516 . . . . 0.0 110.245 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.512 HG22 HG12 ' A' ' 87' ' ' VAL . 23.4 p -117.88 135.45 54.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.025 -178.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.633 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 89.4 m-85 -133.43 143.54 48.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.519 -179.749 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 p -113.84 136.97 52.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.199 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.425 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 38.6 mm -117.27 125.03 28.5 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.885 0.374 . . . . 0.0 110.699 -176.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.43 140.15 21.4 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.075 2.517 . . . . 0.0 112.212 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.78 152.11 74.13 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.949 2.432 . . . . 0.0 112.249 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.44 ' HB3' ' OD1' ' A' ' 15' ' ' ASP . 47.9 t -90.98 151.68 20.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.308 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.558 ' HE1' ' HE3' ' A' ' 102' ' ' LYS . 58.2 m-85 -60.93 -31.86 71.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.242 -174.442 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.5 75.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.507 ' HA ' HD11 ' A' ' 18' ' ' LEU . 9.3 m-20 -74.48 -24.96 59.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.363 0.602 . . . . 0.0 110.72 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.411 HG13 ' O ' ' A' ' 12' ' ' SER . 69.8 mt -74.48 -25.27 19.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.651 0.739 . . . . 0.0 109.384 172.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.647 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 11.3 t80 -73.7 -47.62 38.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.355 -175.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.795 HD12 ' H ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -77.94 -36.36 49.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.362 0.601 . . . . 0.0 111.547 -169.971 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.795 ' H ' HD12 ' A' ' 18' ' ' LEU . 24.1 t -89.85 -8.45 51.95 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.988 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.3 mttm 59.07 16.32 4.67 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.015 -178.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.1 m -139.77 152.81 46.89 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.509 ' O ' HG23 ' A' ' 72' ' ' VAL . . . -94.09 122.61 36.78 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.463 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 19.9 m120 -106.28 128.35 53.91 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.429 0.633 . . . . 0.0 111.071 -174.285 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.57 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 85.9 mt -84.29 138.01 33.15 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.886 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.425 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 89.7 m -124.92 117.63 24.49 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.38 0.61 . . . . 0.0 110.497 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.554 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.6 t -109.93 131.99 54.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.417 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.527 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.1 tt -126.24 130.67 51.37 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.171 0.51 . . . . 0.0 110.54 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.46 HG13 HD22 ' A' ' 31' ' ' LEU . 44.9 t -122.36 125.28 72.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.754 -178.691 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.53 ' HB3' ' OG ' ' A' ' 65' ' ' SER . 14.5 p -138.91 176.26 8.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.226 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . 0.457 ' HB2' HD21 ' A' ' 5' ' ' LEU . 3.8 m-20 59.05 46.7 13.0 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.644 0.59 . . . . 0.0 111.041 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.656 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 15.8 mt -79.74 160.23 26.3 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.99 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.79 -22.34 15.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.688 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 0.2 OUTLIER 68.25 52.27 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 112.87 -1.968 . . . . 0.0 112.68 163.45 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.667 ' HD2' ' CD1' ' A' ' 34' ' ' TYR . 18.2 t80 -84.02 -6.61 59.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.647 173.236 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.517 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 7.9 tp10 -164.27 168.02 19.24 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.91 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.437 ' N ' ' HG3' ' A' ' 35' ' ' GLU . 7.1 p -69.13 171.36 8.43 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.794 178.645 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.659 HD11 ' N ' ' A' ' 38' ' ' ASN . 1.9 tm? -122.71 161.29 24.16 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.65 -175.69 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.659 ' N ' HD11 ' A' ' 37' ' ' LEU . 4.7 t-20 -152.75 154.22 34.79 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.523 HG22 ' HA3' ' A' ' 68' ' ' GLY . 20.2 mm -119.74 135.82 58.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -132.06 135.16 46.28 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.732 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.554 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 56.9 m95 -116.74 138.6 51.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.024 0.44 . . . . 0.0 110.818 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -150.23 162.29 40.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.322 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.488 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 36.6 t -74.82 168.07 20.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -63.67 -24.35 67.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.928 0.394 . . . . 0.0 111.391 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.7 m -83.55 3.38 32.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.408 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.48 22.13 54.7 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.861 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.488 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 36.3 mt-10 -87.46 121.78 70.98 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -178.334 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 48.3 Cg_exo -56.38 142.67 88.42 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 123.326 2.684 . . . . 0.0 113.28 -175.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 4.5 mt -123.17 146.8 47.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.713 178.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.63 108.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.96 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.439 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 8.5 m -131.56 131.08 43.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.145 -177.145 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -113.94 122.73 47.86 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.155 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.476 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 50.6 mm -122.31 120.14 60.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.141 -178.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -107.52 136.83 46.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.259 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.605 HG13 ' H ' ' A' ' 57' ' ' GLU . 36.9 t 72.19 111.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.005 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.454 ' HE2' ' HB2' ' A' ' 38' ' ' ASN . 92.8 mmm -74.72 10.16 1.51 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.553 0.692 . . . . 0.0 111.154 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.605 ' H ' HG13 ' A' ' 55' ' ' VAL . 42.7 mt-10 -121.46 157.26 30.99 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -177.937 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.3 m -75.06 146.56 41.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -174.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.481 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 50.2 m170 -91.85 129.27 42.74 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.528 -168.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.611 ' HA ' ' O ' ' A' ' 63' ' ' THR . 10.4 Cg_endo -91.4 -148.82 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 123.565 2.843 . . . . 0.0 112.112 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.444 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 93.2 m-20 63.58 68.38 0.6 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.13 0.49 . . . . 0.0 110.186 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.84 12.63 83.28 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -178.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.611 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 3.3 m -145.41 153.71 41.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -177.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -132.2 22.93 4.47 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 174.628 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.568 ' H ' HG23 ' A' ' 63' ' ' THR . 8.2 m -129.91 171.91 12.24 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.073 -165.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.527 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.12 150.03 28.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.369 175.401 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.493 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 20.4 ttmm -131.58 139.31 49.16 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -132.92 128.76 5.23 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.61 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.57 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.6 t -114.43 125.01 71.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.728 0.299 . . . . 0.0 111.24 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.463 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -118.44 146.76 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.068 175.816 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.4 m -100.33 122.29 42.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.825 0.345 . . . . 0.0 110.662 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.509 HG23 ' O ' ' A' ' 22' ' ' ALA . 1.5 m -122.42 167.24 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.36 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -71.76 143.01 49.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.85 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -61.8 -35.25 66.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.818 0.818 . . . . 0.0 108.85 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.89 -32.35 74.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.787 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.02 -47.62 83.93 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.578 ' HH2' HG12 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -67.87 -42.83 80.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.754 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.64 -28.0 68.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.534 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -89.43 7.39 36.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.602 0.239 . . . . 0.0 110.739 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 64.81 37.32 7.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.007 176.53 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.41 ' HB3' ' HE3' ' A' ' 81' ' ' LYS . 26.7 mmmt -72.44 160.01 33.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.185 178.434 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -124.06 138.82 54.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.806 -177.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.641 ' HD2' ' CD1' ' A' ' 83' ' ' PHE . 90.9 m-85 -122.73 160.98 24.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.705 -178.282 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.1 t -124.62 128.89 73.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.056 0.455 . . . . 0.0 110.854 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.728 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 26.4 p -106.5 142.98 35.27 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.02 176.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.424 HG21 ' HG2' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -122.48 121.59 36.93 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.255 0.55 . . . . 0.0 110.999 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.57 HG21 HD23 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -104.27 134.96 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.353 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.8 92.92 3.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.307 0.575 . . . . 0.0 110.425 -173.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.688 ' CE1' ' HA ' ' A' ' 33' ' ' THR . 3.2 t-160 -99.03 -10.98 21.92 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.25 9.78 2.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.773 0.797 . . . . 0.0 110.092 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.479 ' HB3' HD12 ' A' ' 4' ' ' ILE . 43.9 t0 -101.7 -23.67 14.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.959 -173.686 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.481 HD23 ' HG3' ' A' ' 96' ' ' GLN . 0.4 OUTLIER -108.55 160.33 27.58 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.058 179.718 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.13 -32.51 94.72 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.115 1.877 . . . . 0.0 112.826 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.406 ' O ' HD11 ' A' ' 92' ' ' LEU . 23.1 t -153.68 141.7 13.91 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -177.994 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.92 140.8 47.84 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.011 2.474 . . . . 0.0 111.571 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.481 ' HG3' HD23 ' A' ' 92' ' ' LEU . 41.8 mt-30 -89.68 130.02 36.02 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.805 -175.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.55 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 52.3 mtmt -101.9 126.82 48.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.374 176.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.728 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -123.3 141.94 51.46 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.94 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -99.7 142.79 30.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.899 -176.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.578 HG12 ' HH2' ' A' ' 77' ' ' TRP . 13.6 tt -134.87 137.56 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.152 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.9 t -157.97 149.84 21.84 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.108 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HE3' ' HE1' ' A' ' 13' ' ' PHE . 76.4 tttt . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.495 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 ppp? . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.965 0.412 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.537 ' HA3' ' CB ' ' A' ' 32' ' ' ALA . . . 166.21 -44.91 0.27 Allowed Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 66.74 72.69 0.37 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.598 0.713 . . . . 0.0 111.799 172.222 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.623 HG21 HD21 ' A' ' 31' ' ' LEU . 76.2 mt -64.64 122.93 16.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.051 176.358 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.1 mt -109.48 130.58 55.49 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.93 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.9 t -111.4 133.48 53.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.325 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.67 ' HD2' ' CD1' ' A' ' 7' ' ' PHE . 68.3 m-85 -125.21 142.27 51.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.725 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.2 p -115.6 136.81 52.7 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.909 0.385 . . . . 0.0 111.129 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . 0.482 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -118.71 125.98 27.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.022 178.354 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -78.94 139.57 15.46 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.786 2.324 . . . . 0.0 111.622 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -69.96 149.77 66.05 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.573 2.182 . . . . 0.0 111.81 178.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.47 ' O ' HG13 ' A' ' 16' ' ' ILE . 21.8 m -88.26 137.3 32.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.403 -177.326 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 1.603 ' HE1' ' CE2' ' A' ' 13' ' ' PHE . 75.6 t80 -54.18 -37.39 64.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.772 -1.103 . . . . 0.0 112.996 -169.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.38 -46.56 69.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.82 0.343 . . . . 0.0 110.653 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.95 -38.93 93.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.664 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.525 HD13 ' HA ' ' A' ' 13' ' ' PHE . 89.1 mt -58.26 -39.85 75.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.798 176.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -69.41 -44.6 71.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.805 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.402 HD11 ' HA ' ' A' ' 18' ' ' LEU . 4.4 mm? -69.87 -44.6 69.47 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.331 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.488 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -70.8 -7.66 46.87 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.884 -178.277 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 72.48 -18.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.549 0.739 . . . . 0.0 111.517 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.488 ' H ' ' C ' ' A' ' 19' ' ' SER . 57.4 m -138.72 162.35 34.9 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 176.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.559 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -99.19 159.32 15.07 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.518 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -128.08 134.54 49.17 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.237 0.542 . . . . 0.0 110.384 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.56 ' HB2' ' HB2' ' A' ' 70' ' ' ALA . 70.8 mt -88.35 126.04 35.0 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' THR . . . . . 0.482 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 62.7 m -111.0 112.32 24.06 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.413 0.625 . . . . 0.0 111.065 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.494 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 37.7 t -111.77 129.12 56.23 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.322 176.663 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -124.1 123.35 40.13 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.554 HG12 HG12 ' A' ' 87' ' ' VAL . 12.0 t -118.15 119.95 62.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.426 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.2 t -135.04 178.2 7.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.33 -174.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.8 41.86 20.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.345 0.593 . . . . 0.0 110.764 -176.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.623 HD21 HG21 ' A' ' 4' ' ' ILE . 43.4 mt -70.38 126.14 28.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.745 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.537 ' CB ' ' HA3' ' A' ' 2' ' ' GLY . . . -56.35 -31.21 63.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.352 -175.716 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.422 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 70.9 p -125.98 -1.5 7.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.372 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.47 ' HA ' ' HB2' ' A' ' 31' ' ' LEU . 80.5 m-85 52.51 -127.68 2.42 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.399 -171.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.422 ' HG3' ' O ' ' A' ' 33' ' ' THR . 47.7 mt-10 61.06 -144.84 0.46 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.277 0.56 . . . . 0.0 111.933 176.329 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.951 HG21 ' HA ' ' A' ' 56' ' ' MET . 10.3 m -67.6 135.65 53.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.744 -176.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.716 HD21 ' HB1' ' A' ' 66' ' ' ALA . 47.5 tp -142.0 161.49 37.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.936 178.343 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -132.01 151.34 51.8 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.535 ' HB ' HG12 ' A' ' 53' ' ' ILE . 25.0 mm -121.08 140.29 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.242 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -142.19 135.68 29.18 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 122.019 -0.426 . . . . 0.0 111.456 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.52 ' HD1' HG22 ' A' ' 51' ' ' THR . 67.6 m95 -119.21 149.88 41.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.888 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.45 144.67 18.46 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.192 175.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -65.09 163.17 15.4 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.351 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 31.1 tt0 -53.43 -31.6 46.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.228 0.537 . . . . 0.0 110.941 -179.815 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.8 t -72.87 -0.68 14.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.075 -178.733 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.51 17.77 67.82 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.57 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.454 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 52.5 mt-10 -93.99 127.86 43.52 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -176.115 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.454 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.7 Cg_exo -57.97 136.32 74.36 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 123.036 2.491 . . . . 0.0 112.911 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.572 HD13 ' HB3' ' A' ' 70' ' ' ALA . 0.3 OUTLIER -97.69 146.84 24.94 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.915 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.447 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 6.8 tp10 -67.31 104.67 1.55 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.292 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.821 HG23 HD12 ' A' ' 53' ' ' ILE . 1.7 m -145.79 128.51 16.23 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.287 -177.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -123.19 120.09 32.14 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.694 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.821 HD12 HG23 ' A' ' 51' ' ' THR . 3.3 mp -136.83 128.8 43.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.277 178.582 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -130.58 105.12 7.63 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.028 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.414 HG23 HG23 ' A' ' 53' ' ' ILE . 4.0 m -140.27 91.28 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.64 0.733 . . . . 0.0 110.747 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.951 ' HA ' HG21 ' A' ' 36' ' ' THR . 66.2 mtt -77.41 2.56 15.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.025 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -150.81 154.39 37.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.851 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.428 ' HB3' ' O ' ' A' ' 64' ' ' PHE . 12.9 m -76.86 136.02 38.88 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.435 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 1.4 m-70 -93.58 130.17 36.09 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -167.206 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.44 ' HA ' ' O ' ' A' ' 63' ' ' THR . 1.0 OUTLIER -85.72 134.03 4.53 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.551 2.834 . . . . 0.0 111.779 174.082 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -178.87 43.75 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.17 -4.93 84.73 Favored Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -170.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.44 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 0.8 OUTLIER -141.4 169.3 17.86 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.428 ' O ' ' HB3' ' A' ' 58' ' ' SER . 65.0 m-85 -124.08 26.88 7.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.418 0.628 . . . . 0.0 110.054 -175.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.8 p -111.74 174.29 5.95 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.976 -164.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.716 ' HB1' HD21 ' A' ' 37' ' ' LEU . . . -106.84 148.2 28.82 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.92 171.085 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.472 ' HE2' HG21 ' A' ' 25' ' ' THR . 63.5 tttm -132.31 139.23 48.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -175.368 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.514 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -128.97 133.98 7.81 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.782 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 45.7 t -114.49 124.21 70.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.572 ' HB3' HD13 ' A' ' 49' ' ' LEU . . . -114.85 155.98 25.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.4 179.112 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 m -108.41 121.35 44.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.673 0.273 . . . . 0.0 110.998 -172.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.559 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 4.2 m -128.34 153.35 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.211 0.529 . . . . 0.0 110.115 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 m -77.5 145.93 36.71 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.994 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.9 t -58.03 -33.57 46.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.463 0.649 . . . . 0.0 109.663 178.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -57.63 -42.34 83.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.222 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -67.58 -41.35 84.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CD1' ' HG2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -68.98 -35.14 76.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.185 179.468 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -69.62 -26.28 64.36 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.052 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -91.51 7.1 42.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.028 0.442 . . . . 0.0 110.004 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 60.02 39.13 20.27 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.582 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.551 ' HE2' ' HA ' ' A' ' 81' ' ' LYS . 3.2 mmpt? -56.67 147.45 22.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.962 174.344 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.436 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -115.0 139.33 49.94 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.882 178.042 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.667 ' HE2' ' CE1' ' A' ' 83' ' ' PHE . 94.4 m-85 -125.5 158.09 35.36 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.524 -176.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.52 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 76.6 t -123.06 125.52 72.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.575 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.653 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.8 p -105.76 135.44 47.17 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.478 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.452 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.2 OUTLIER -125.31 136.29 53.33 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.554 HG12 HG12 ' A' ' 28' ' ' VAL . 28.8 t -110.57 127.72 67.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.829 0.347 . . . . 0.0 111.154 -175.704 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 p -114.85 90.17 3.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.418 0.628 . . . . 0.0 111.409 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -98.66 -15.41 19.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.667 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER 64.12 24.02 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.486 -178.548 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -98.91 -36.51 9.74 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.51 0.671 . . . . 0.0 109.462 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.468 HD11 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -100.08 148.03 34.29 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.808 172.41 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.53 -22.48 38.45 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.269 2.646 . . . . 0.0 112.884 -172.109 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.468 ' O ' HD11 ' A' ' 92' ' ' LEU . 14.3 m -132.88 130.07 21.4 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.428 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 24.5 Cg_exo -62.56 141.0 84.59 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.464 2.109 . . . . 0.0 112.139 -178.645 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.452 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.4 pt20 -87.99 142.01 28.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.395 -178.58 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.464 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 20.1 ptmt -127.17 148.47 50.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.225 0.536 . . . . 0.0 111.209 -175.74 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.653 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 61.6 mmtt -134.15 145.6 49.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.611 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 1.619 ' HE1' ' CE2' ' A' ' 99' ' ' PHE . 34.3 m-85 -105.7 142.69 35.01 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.073 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.436 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 9.7 tt -142.38 138.12 29.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.766 0.317 . . . . 0.0 111.191 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 p -158.34 148.66 20.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.775 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.679 ' HG2' ' CD1' ' A' ' 77' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.822 -0.609 . . . . 0.0 110.022 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttp . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.731 0.301 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.18 152.42 22.17 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.55 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -92.64 132.46 36.87 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.589 HG12 ' HA ' ' A' ' 31' ' ' LEU . 64.5 mt -59.61 121.65 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.51 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -103.98 131.05 51.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.515 -176.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.472 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 11.6 p -117.5 122.17 42.97 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.427 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -133.92 145.41 49.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.034 0.445 . . . . 0.0 110.406 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.8 p -115.41 135.91 53.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.317 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.15 121.82 31.96 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.547 ' HA ' HD12 ' A' ' 100' ' ' ILE . 59.4 Cg_endo -70.44 140.01 39.15 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.751 2.301 . . . . 0.0 111.654 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.458 ' HG2' HD12 ' A' ' 16' ' ' ILE . 66.1 Cg_endo -68.88 144.96 60.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.26 1.973 . . . . 0.0 110.806 176.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -79.2 138.15 37.72 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -54.05 -42.59 69.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.72 0.295 . . . . 0.0 111.287 -170.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.655 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.4 -38.25 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.339 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -66.27 -35.9 81.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.059 0.457 . . . . 0.0 110.349 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.458 HD12 ' HG2' ' A' ' 11' ' ' PRO . 53.7 mt -67.36 -32.04 55.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.01 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.617 ' HD2' ' CD1' ' A' ' 17' ' ' PHE . 29.8 t80 -66.49 -36.94 83.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.652 177.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.655 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.0 mt -76.82 -48.01 19.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.006 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.7 m -80.53 -10.35 59.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.408 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.466 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 63.2 mmtt 71.05 -57.09 0.61 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.557 0.743 . . . . 0.0 111.739 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.415 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 20.0 m -95.08 127.17 40.93 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 176.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.545 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -60.97 145.53 50.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.777 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.496 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -120.62 124.53 45.48 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.302 0.572 . . . . 0.0 110.558 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.58 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 83.5 mt -83.36 130.52 35.06 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.807 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 m -115.26 122.76 46.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.183 0.516 . . . . 0.0 111.139 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.405 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.9 t -111.27 138.47 47.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.723 -178.681 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -126.19 122.45 35.67 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 t -127.86 120.83 54.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 t -137.43 177.08 8.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.5 -173.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.6 35.8 24.74 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.116 0.566 . . . . 0.0 112.048 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.676 ' HB2' ' HA ' ' A' ' 34' ' ' TYR . 48.9 mt -60.07 124.95 21.82 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.39 -25.87 60.19 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -170.316 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.509 HG21 ' HB2' ' A' ' 35' ' ' GLU . 12.7 t -129.86 7.55 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.633 0.254 . . . . 0.0 110.86 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.647 ' HD2' ' CD1' ' A' ' 34' ' ' TYR . 48.9 m-85 56.51 -87.36 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.77 -171.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.881 ' HG3' ' H ' ' A' ' 36' ' ' THR . 6.8 tp10 55.02 -154.23 0.3 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.027 0.441 . . . . 0.0 111.467 170.514 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.881 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 8.1 t -85.69 163.63 18.13 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.553 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.516 ' HB3' ' OG ' ' A' ' 58' ' ' SER . 66.4 tp -160.08 151.26 19.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 179.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -119.51 152.66 36.59 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.527 HG22 ' HA3' ' A' ' 68' ' ' GLY . 22.3 mm -120.43 135.82 59.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 m -139.27 125.84 20.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.077 0.465 . . . . 0.0 111.531 -176.493 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.533 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 85.8 m95 -106.81 148.2 28.79 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.122 174.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.0 156.13 36.83 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . 0.733 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 22.8 m -87.84 156.8 19.21 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -60.24 -19.98 56.9 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -72.76 -7.35 50.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.211 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.8 18.24 41.44 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.041 176.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.733 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 13.2 pt-20 -101.81 133.9 20.48 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 120.507 0.194 . . . . 0.0 110.745 -177.222 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.467 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 12.1 Cg_exo -69.78 136.79 33.81 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.676 2.251 . . . . 0.0 112.416 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.0 mt -106.08 142.02 36.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.62 177.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -64.57 106.72 1.21 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.938 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 12.2 m -104.89 116.78 32.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.804 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -93.99 120.8 34.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.528 0.68 . . . . 0.0 110.447 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.504 ' C ' ' HD2' ' A' ' 54' ' ' LYS . 41.8 mt -134.44 138.87 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.923 -176.153 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.504 ' HD2' ' C ' ' A' ' 53' ' ' ILE . 3.6 mptp? -121.95 147.07 46.5 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 173.248 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.405 HG13 ' H ' ' A' ' 57' ' ' GLU . 57.9 t 75.55 116.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 123.98 0.8 . . . . 0.0 109.898 -174.004 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 93.2 mmm -79.22 8.84 5.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.357 -172.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.405 ' H ' HG13 ' A' ' 55' ' ' VAL . 13.4 pt-20 -130.53 153.33 48.95 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.516 ' OG ' ' HB3' ' A' ' 37' ' ' LEU . 28.8 m -82.1 162.36 22.54 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.666 ' HB2' ' HB ' ' A' ' 63' ' ' THR . 96.2 m-70 -100.77 126.96 33.65 Favored Pre-proline 0 C--N 1.32 -0.698 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.989 -174.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -103.29 -0.95 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 123.834 3.023 . . . . 0.0 112.045 170.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.473 ' C ' ' H ' ' A' ' 63' ' ' THR . 45.1 t-20 -142.37 128.14 19.3 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 -174.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.79 -30.74 2.55 Favored Glycine 0 CA--C 1.517 0.209 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -174.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.666 ' HB ' ' HB2' ' A' ' 59' ' ' HIS . 7.1 m -144.28 158.1 43.92 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 173.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.653 ' HD2' ' CD1' ' A' ' 64' ' ' PHE . 93.4 m-85 -121.21 23.62 10.42 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 118.407 0.549 . . . . 0.0 110.971 -177.656 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.5 p -156.18 172.74 17.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.659 0.742 . . . . 0.0 112.885 -170.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.417 ' HB3' ' OG ' ' A' ' 58' ' ' SER . . . -108.71 148.34 30.61 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.112 167.298 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -131.48 140.64 49.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.527 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -136.69 127.49 4.11 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.608 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.58 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 43.3 t -115.08 128.29 72.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.759 0.314 . . . . 0.0 110.596 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.496 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -116.53 148.64 40.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.69 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 m -99.93 124.1 44.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.266 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.545 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 3.6 m -119.73 166.96 13.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.456 ' HB3' ' OD2' ' A' ' 76' ' ' ASP . 23.2 t -86.68 154.29 21.1 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.193 -178.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.37 -39.66 85.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.076 0.465 . . . . 0.0 110.67 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -58.36 -36.24 73.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.789 -178.159 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.456 ' OD2' ' HB3' ' A' ' 73' ' ' SER . 13.3 m-20 -63.94 -45.02 91.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.335 0.588 . . . . 0.0 110.094 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.432 ' HE1' ' HD2' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.5 -35.07 68.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.196 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -65.76 -30.22 70.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.235 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 95.3 m-20 -90.85 7.27 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.096 179.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 57.89 36.77 26.6 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.387 0.43 . . . . 0.0 110.912 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -68.93 163.31 24.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.336 -177.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.3 mt-10 -114.69 139.75 49.41 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.507 179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 99' ' ' PHE . 75.1 m-85 -121.14 157.29 30.47 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.792 177.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 93.5 t -120.75 129.0 76.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 0.0 110.967 -176.059 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.533 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 34.9 t -106.18 127.62 53.34 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.12 126.16 52.38 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.455 ' CG1' HD12 ' A' ' 37' ' ' LEU . 54.1 t -105.9 125.67 61.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.143 0.497 . . . . 0.0 111.1 -177.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.1 p -120.56 103.9 9.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.723 ' ND1' ' HB2' ' A' ' 91' ' ' ASP . 39.6 t-80 -98.39 -20.37 17.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.048 -176.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.517 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 18.9 ttt180 74.04 8.13 4.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.008 0.908 . . . . 0.0 108.786 -169.801 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.723 ' HB2' ' ND1' ' A' ' 89' ' ' HIS . 11.2 t0 -93.58 -36.41 12.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.773 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -119.32 151.96 51.88 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.319 178.501 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.58 -31.33 11.05 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 123.017 2.478 . . . . 0.0 112.801 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.3 m -116.77 111.54 41.17 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.168 -176.802 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.91 141.25 83.63 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.257 1.971 . . . . 0.0 111.939 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -86.43 127.4 34.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -112.76 128.31 56.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.305 178.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 64.5 mmtt -122.77 149.32 44.27 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.023 -174.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . 0.412 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.4 m-85 -105.73 146.79 29.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.966 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.547 HD12 ' HA ' ' A' ' 10' ' ' PRO . 13.8 tt -136.34 138.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.265 175.324 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.7 t -158.85 149.92 20.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.523 177.726 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.821 ' HA ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.558 -0.735 . . . . 0.0 110.321 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.5 ttm . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.854 0.359 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.06 -86.75 0.12 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.974 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -78.69 118.45 20.79 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.549 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.1 mt -70.7 123.12 24.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.264 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.1 mt -104.95 131.03 52.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.009 0.433 . . . . 0.0 110.345 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.406 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 13.9 p -109.42 123.48 49.42 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.843 -179.067 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -119.32 131.39 55.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 3.2 p -119.51 131.57 55.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.369 176.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.88 124.48 28.75 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.975 0.417 . . . . 0.0 110.495 -178.789 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.41 140.73 24.69 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.886 2.391 . . . . 0.0 111.507 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.538 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 51.8 Cg_endo -64.85 147.41 89.44 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.578 2.185 . . . . 0.0 111.845 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.41 ' O ' HG13 ' A' ' 16' ' ' ILE . 10.7 p -89.56 146.44 24.58 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.136 -177.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . 0.807 ' HE1' ' HE2' ' A' ' 102' ' ' LYS . 47.9 m-85 -59.76 -31.39 69.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.446 -174.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.15 76.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.563 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.02 -35.07 66.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.502 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 12' ' ' SER . 83.1 mt -63.46 -32.02 55.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.461 176.11 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . 1.668 ' HD1' ' CD2' ' A' ' 17' ' ' PHE . 79.6 t80 -62.99 -43.93 97.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.405 177.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.98 -47.87 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.422 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.402 ' C ' ' H ' ' A' ' 21' ' ' SER . 44.6 m -70.69 -24.24 62.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.972 -177.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt 70.94 -6.07 1.36 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.496 0.718 . . . . 0.0 111.368 -177.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.402 ' H ' ' C ' ' A' ' 19' ' ' SER . 71.3 p -137.9 161.99 35.2 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.73 32.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -125.88 130.26 50.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.986 0.422 . . . . 0.0 110.057 -177.562 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.436 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 88.6 mt -86.29 128.91 34.99 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.45 -176.574 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 18.2 m -109.05 114.4 28.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.504 -178.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.593 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 25.3 t -114.05 134.82 54.61 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.117 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -135.97 129.11 31.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.142 0.496 . . . . 0.0 110.109 175.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.561 ' HB ' HD23 ' A' ' 37' ' ' LEU . 15.4 t -123.35 132.87 70.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' SER . . . . . 0.409 ' CB ' ' HG ' ' A' ' 65' ' ' SER . 8.9 t -143.3 171.84 13.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.156 0.503 . . . . 0.0 111.557 -173.934 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 64.51 48.95 2.53 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.173 169.821 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.549 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -72.79 157.17 38.0 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.098 -1.41 . . . . 0.0 109.122 178.754 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.89 70.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.881 0.372 . . . . 0.0 110.926 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.5 t -158.58 151.08 21.88 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.351 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 1.647 ' HD1' ' CD2' ' A' ' 34' ' ' TYR . 24.9 m-85 65.64 91.97 0.08 Allowed 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.029 0.83 . . . . 0.0 111.274 176.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.48 ' HB3' ' HB2' ' A' ' 58' ' ' SER . 37.7 mp0 -75.8 58.98 1.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.425 0.631 . . . . 0.0 111.089 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.51 HG21 ' HG2' ' A' ' 57' ' ' GLU . 11.3 m -93.62 -68.22 0.81 Allowed 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 171.625 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.561 HD23 ' HB ' ' A' ' 28' ' ' VAL . 18.8 tp 63.21 171.45 0.15 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.57 170.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.403 ' H ' ' HG ' ' A' ' 37' ' ' LEU . 4.9 t-20 -143.49 151.05 39.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.307 -0.86 . . . . 0.0 108.911 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.523 HG22 ' HA3' ' A' ' 68' ' ' GLY . 17.5 mm -121.14 136.05 59.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.842 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 t -145.67 128.58 16.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.896 0.379 . . . . 0.0 110.863 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.593 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 55.2 m95 -108.7 149.03 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.474 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.55 163.81 38.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.622 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 t -84.68 168.69 15.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -57.37 -29.18 63.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.086 0.47 . . . . 0.0 110.85 -179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -73.66 -4.3 33.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.526 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.1 20.79 54.52 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.812 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.8 mt-10 -99.64 123.6 47.29 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 32.2 Cg_exo -58.66 137.55 80.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.154 2.569 . . . . 0.0 113.217 -173.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -106.34 148.35 28.14 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.664 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.51 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 39.4 mm-40 -62.71 106.59 0.82 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.808 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.61 HG23 HD12 ' A' ' 53' ' ' ILE . 3.1 m -117.68 113.88 22.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.874 -177.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -105.01 120.92 42.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.125 0.488 . . . . 0.0 110.957 -177.586 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.61 HD12 HG23 ' A' ' 51' ' ' THR . 4.1 mp -134.4 127.33 50.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.665 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -97.7 146.92 24.88 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.543 HG13 ' H ' ' A' ' 57' ' ' GLU . 42.2 t 75.68 120.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 O-C-N 124.043 0.839 . . . . 0.0 109.437 -169.771 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.7 mtt -84.89 8.39 17.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.921 -175.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . 0.543 ' H ' HG13 ' A' ' 55' ' ' VAL . 48.1 mt-10 -127.24 156.66 41.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.801 -177.805 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' SER . . . . . 0.48 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . 18.2 m -76.86 154.75 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.425 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 33.3 m170 -93.33 128.91 40.78 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.492 -171.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.425 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 96.2 Cg_endo -97.3 30.95 0.15 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 123.263 2.642 . . . . 0.0 112.631 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -104.01 106.95 17.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.176 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.67 -49.69 4.27 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.451 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.6 m -137.08 169.43 17.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 64' ' ' PHE . 91.1 m-85 -98.95 29.92 3.61 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 122.931 0.493 . . . . 0.0 111.41 -175.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.409 ' HG ' ' CB ' ' A' ' 29' ' ' SER . 1.0 OUTLIER -107.58 163.62 12.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.669 0.747 . . . . 0.0 112.859 -165.086 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.474 ' HB1' HD12 ' A' ' 39' ' ' ILE . . . -109.54 158.51 17.94 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.287 175.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -134.23 140.43 46.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.747 0.308 . . . . 0.0 110.462 -176.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.523 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -139.43 138.69 9.45 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -123.2 129.0 75.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.802 0.334 . . . . 0.0 110.78 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.51 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.61 150.49 37.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.406 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.4 m -102.63 119.85 39.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.8 m -127.19 166.4 23.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.977 0.418 . . . . 0.0 110.779 -176.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.563 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.8 m -85.16 137.62 32.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.271 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -65.67 -24.98 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.436 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.2 -33.95 76.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.034 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . 0.563 ' OD1' ' HB2' ' A' ' 73' ' ' SER . 3.5 m-20 -66.11 -41.32 90.71 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.538 ' CZ2' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -65.86 -41.33 91.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.072 177.455 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.28 -30.07 69.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.995 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -91.38 8.01 38.28 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.214 -0.195 . . . . 0.0 111.061 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.97 37.26 21.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.467 -178.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -67.2 161.83 23.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.05 0.453 . . . . 0.0 110.146 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -112.65 140.53 47.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.445 179.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.415 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.9 m-85 -121.32 149.69 42.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.482 176.081 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.521 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 90.2 t -123.01 120.33 60.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.083 -173.591 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.641 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.7 p -105.67 135.32 47.3 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.431 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.2 m -122.38 132.94 54.62 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.775 0.322 . . . . 0.0 110.156 -177.366 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.451 HG12 HG12 ' A' ' 28' ' ' VAL . 44.3 t -109.1 126.99 66.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.766 -178.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -117.8 88.5 2.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.59 0.709 . . . . 0.0 111.58 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.538 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 23.5 t60 -98.82 -6.89 28.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.514 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.538 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 0.1 OUTLIER 52.29 24.09 2.7 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.901 -175.169 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -94.05 -28.51 15.69 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.562 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.481 HD11 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -118.23 156.07 51.01 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.049 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.52 -21.86 39.4 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.056 2.504 . . . . 0.0 113.106 -175.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.481 ' O ' HD11 ' A' ' 92' ' ' LEU . 37.5 p -134.63 125.0 17.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.499 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.423 ' HB2' HG23 ' A' ' 86' ' ' THR . 18.0 Cg_endo -61.35 141.38 92.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.585 2.19 . . . . 0.0 111.412 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.431 ' O ' ' HA ' ' A' ' 86' ' ' THR . 33.2 mt-30 -80.58 126.73 31.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.964 0.411 . . . . 0.0 111.148 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -107.36 126.71 52.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.368 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.641 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 16.7 mmtt -115.27 133.78 55.73 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.967 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.21 122.75 44.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.799 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.5 tt -122.17 139.89 47.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.159 178.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -157.28 150.01 23.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.047 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.807 ' HE2' ' HE1' ' A' ' 13' ' ' PHE . 47.7 tttm . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.813 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 120.845 0.355 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.885 ' HA2' ' HB3' ' A' ' 32' ' ' ALA . . . -96.48 48.61 1.69 Allowed Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.672 -176.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -87.28 74.99 9.38 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 -173.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.593 HG21 HD21 ' A' ' 31' ' ' LEU . 73.5 mt -60.4 121.49 8.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.228 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.31 138.32 43.72 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.257 -176.133 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.553 HG23 HG23 ' A' ' 28' ' ' VAL . 2.2 p -115.05 120.07 38.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.858 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . 1.63 ' HE2' ' CE1' ' A' ' 7' ' ' PHE . 97.6 m-85 -119.36 132.01 55.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 178.724 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 p -115.63 132.48 56.62 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.258 176.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.96 125.92 27.64 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.81 0.338 . . . . 0.0 110.427 -177.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . 0.495 ' HA ' HD12 ' A' ' 100' ' ' ILE . 55.9 Cg_endo -70.75 139.59 37.1 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.612 2.208 . . . . 0.0 111.444 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.506 ' HG2' HD12 ' A' ' 16' ' ' ILE . 55.7 Cg_endo -68.81 154.96 70.18 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.736 2.29 . . . . 0.0 112.447 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.442 ' O ' HG13 ' A' ' 16' ' ' ILE . 11.9 p -84.82 126.09 33.15 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 -177.599 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -61.4 -30.83 70.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.554 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.48 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -62.18 -40.28 95.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 177.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.04 -43.14 58.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.903 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.506 HD12 ' HG2' ' A' ' 11' ' ' PRO . 76.5 mt -57.69 -32.69 43.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.469 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.08 -39.0 93.41 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.43 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . 0.48 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 41.1 mt -72.6 -48.14 42.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.557 -173.27 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.8 p -86.46 -18.16 32.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.865 0.364 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm 68.87 16.12 8.87 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.734 0.813 . . . . 0.0 110.117 -174.738 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -135.35 128.88 32.53 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.314 -176.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.426 ' HB1' ' CG2' ' A' ' 72' ' ' VAL . . . -87.14 136.61 32.86 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.613 176.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.471 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 48.8 m-80 -122.93 125.9 46.21 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.147 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.466 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 70.9 mt -83.46 131.08 35.04 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.003 -178.068 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.2 m -119.07 121.19 39.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.286 0.565 . . . . 0.0 110.949 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' CYS . . . . . 0.561 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.4 t -126.88 137.97 53.24 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.171 178.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.406 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 3.9 tt -133.5 132.9 41.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.009 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.581 HG22 HG22 ' A' ' 87' ' ' VAL . 43.6 t -115.12 118.52 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.864 -178.101 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.9 p -121.2 178.57 4.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.869 -169.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 59.17 35.88 23.76 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.464 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.593 HD21 HG21 ' A' ' 4' ' ' ILE . 9.7 mt -71.79 123.64 23.08 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . 0.885 ' HB3' ' HA2' ' A' ' 2' ' ' GLY . . . -60.93 -49.81 75.93 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.143 0.496 . . . . 0.0 110.922 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.6 t -126.88 134.7 50.43 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 170.429 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -123.56 142.96 50.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.322 0.582 . . . . 0.0 111.703 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -155.43 -85.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.76 -1.109 . . . . 0.0 108.859 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 0.561 HG23 ' HA ' ' A' ' 56' ' ' MET . 7.4 p -108.92 89.93 3.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.5 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.541 HD22 ' HB ' ' A' ' 28' ' ' VAL . 48.1 tp -95.3 147.86 23.04 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t30 -133.4 146.18 50.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.385 -177.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ILE . . . . . 0.49 HG22 ' HA3' ' A' ' 68' ' ' GLY . 25.2 mm -120.08 134.41 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 m -129.32 133.84 47.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.041 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TRP . . . . . 0.561 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 79.6 m95 -111.77 146.59 37.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.23 174.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.07 164.39 38.1 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.927 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.4 t -73.8 167.17 21.96 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.452 ' HA ' HG21 ' A' ' 84' ' ' VAL . 35.9 tt0 -59.78 -31.22 69.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.008 0.432 . . . . 0.0 110.841 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 18.4 m -75.11 -6.81 51.52 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.435 179.06 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.35 19.69 37.77 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.295 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.435 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 6.6 mm-40 -81.77 122.42 80.25 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 23.3 Cg_exo -62.38 135.8 55.85 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.546 2.164 . . . . 0.0 113.352 -172.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD21 ' HA ' ' A' ' 49' ' ' LEU . 7.6 mt -105.91 148.36 27.71 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.217 177.353 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.65 106.33 2.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.419 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' THR . . . . . 0.41 HG23 HD12 ' A' ' 53' ' ' ILE . 18.1 m -144.06 114.32 7.45 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.824 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -115.99 120.15 38.2 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.116 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.41 HD12 HG23 ' A' ' 51' ' ' THR . 5.2 mp -135.35 119.72 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.061 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -128.18 105.3 8.27 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.936 176.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -156.76 147.91 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.357 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' MET . . . . . 0.561 ' HA ' HG23 ' A' ' 36' ' ' THR . 0.0 OUTLIER -107.27 8.38 29.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.944 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -131.57 151.19 51.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.739 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.3 m -81.54 165.25 21.33 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' HIS . . . . . 0.526 ' HB2' ' O ' ' A' ' 65' ' ' SER . 10.5 m-70 -91.33 133.72 30.98 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.89 0.376 . . . . 0.0 111.065 -172.416 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' PRO . . . . . 0.424 ' HB2' ' H ' ' A' ' 61' ' ' ASN . 94.6 Cg_endo -93.07 -145.43 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.596 2.864 . . . . 0.0 112.493 178.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . 0.424 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 93.1 m-20 70.9 50.86 0.32 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.331 177.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.54 -0.58 46.15 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.515 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' THR . . . . . 0.687 HG21 ' H ' ' A' ' 65' ' ' SER . 2.7 t -153.28 170.87 19.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.903 0.382 . . . . 0.0 110.54 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 1.635 ' HE1' ' CE2' ' A' ' 64' ' ' PHE . 79.1 m-85 -119.52 25.07 10.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.762 0.792 . . . . 0.0 109.203 177.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.687 ' H ' HG21 ' A' ' 63' ' ' THR . 5.5 m -110.77 172.48 6.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.622 -165.586 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.44 ' CB ' HD21 ' A' ' 37' ' ' LEU . . . -109.49 160.96 15.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.785 177.124 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.427 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.3 ttmt -130.59 139.11 50.41 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLY . . . . . 0.49 ' HA3' HG22 ' A' ' 39' ' ' ILE . . . -126.36 119.65 3.47 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.471 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 46.6 t -108.48 123.98 64.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.808 0.337 . . . . 0.0 110.818 -177.631 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . 0.471 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.98 137.15 52.37 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.081 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.7 m -98.99 116.09 30.44 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.238 0.542 . . . . 0.0 110.144 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' VAL . . . . . 0.426 ' CG2' ' HB1' ' A' ' 22' ' ' ALA . 2.3 m -120.34 166.82 14.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.692 -177.091 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 m -75.95 134.19 40.27 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.584 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.6 p -53.02 -34.07 20.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.762 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -56.83 -40.81 76.71 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.456 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -67.24 -44.67 78.84 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.473 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -63.5 -42.01 98.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.824 176.643 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASN . . . . . 0.584 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 7.5 t30 -73.11 -11.71 60.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.988 -176.314 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -107.18 12.61 28.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 65.74 37.85 5.53 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.783 176.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -76.84 152.72 35.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.115 0.483 . . . . 0.0 111.545 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.53 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 42.6 mt-10 -109.35 138.82 45.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.252 177.15 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 83' ' ' PHE . 70.2 m-85 -125.37 151.92 45.47 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.02 176.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' VAL . . . . . 0.527 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 88.2 t -116.54 129.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.38 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' CYS . . . . . 0.659 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 43.3 t -105.89 131.87 52.69 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' THR . . . . . 0.526 HG23 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -125.99 137.34 53.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.581 HG22 HG22 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -128.29 133.46 66.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.197 0.522 . . . . 0.0 112.139 -173.169 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -114.93 100.44 8.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.681 -177.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' HIS . . . . . 0.479 ' C ' ' H ' ' A' ' 91' ' ' ASP . 18.5 t60 -99.79 -11.03 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.696 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 50.0 ttt180 74.06 -24.05 0.21 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.045 0.538 . . . . 0.0 111.116 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 89' ' ' HIS . 39.0 t70 -71.97 -31.88 66.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.158 0.504 . . . . 0.0 110.46 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.78 152.22 42.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.747 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.29 -21.87 10.09 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.192 2.595 . . . . 0.0 113.249 -176.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . 0.448 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 57.4 p -125.76 114.95 24.71 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.453 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' PRO . . . . . 0.526 ' HB2' HG23 ' A' ' 86' ' ' THR . 16.3 Cg_endo -58.25 141.87 97.02 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 111.228 176.92 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLN . . . . . 0.507 ' O ' ' HA ' ' A' ' 86' ' ' THR . 44.4 mt-30 -91.19 128.47 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.761 -173.24 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.659 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.6 ptmt -111.52 130.19 55.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.211 0.529 . . . . 0.0 110.827 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.527 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 68.1 mmtt -121.56 152.91 38.71 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.733 -177.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.5 130.48 55.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' ILE . . . . . 0.495 HD12 ' HA ' ' A' ' 10' ' ' PRO . 16.0 tt -126.84 144.12 38.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' SER . . . . . 0.53 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 29.5 t -156.77 151.0 25.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.503 -175.763 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' LYS . . . . . 0.433 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 13.8 tmtt? . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.725 -0.655 . . . . 0.0 110.078 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 . . . . . 0 CA--C 1.513 -0.456 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.528 HG23 HD23 ' A' ' 31' ' ' LEU . 67.7 mt -75.67 122.2 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.119 0.485 . . . . 0.0 111.883 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.445 HD23 ' HE2' ' A' ' 7' ' ' PHE . 11.1 mp -103.97 131.57 51.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.276 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.463 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 6.7 t -124.42 127.64 47.84 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.521 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HE2' HD23 ' A' ' 5' ' ' LEU . 93.5 m-85 -138.0 148.7 45.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.52 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.7 p -112.35 141.57 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.738 0.304 . . . . 0.0 110.714 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.3 mm -117.15 122.74 30.82 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 121.114 0.483 . . . . 0.0 110.361 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.25 143.59 17.69 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.013 2.475 . . . . 0.0 111.754 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.68 141.84 38.58 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 121.988 1.792 . . . . 0.0 110.328 175.151 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.412 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.9 m -80.05 156.22 27.2 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.36 -174.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.99 -42.91 69.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.779 0.323 . . . . 0.0 110.266 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -61.68 -45.7 92.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.191 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -62.28 -44.47 96.45 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.972 0.415 . . . . 0.0 110.776 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 12' ' ' SER . 54.8 mt -65.52 -29.44 47.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.54 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -71.49 -39.71 70.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 20.7 mt -67.0 -48.41 68.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.093 -176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -89.52 -23.11 22.12 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.163 -175.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 64.04 19.22 11.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.963 -175.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.4 m -137.74 134.24 35.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.895 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.38 141.36 30.05 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 10.0 p30 -127.27 137.41 52.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.149 0.499 . . . . 0.0 109.899 -176.265 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 84.6 mt -95.86 126.52 41.18 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.687 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 m -120.05 132.47 55.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.835 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 39.7 t -123.1 137.39 54.93 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.73 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 27' ' ' LEU . 2.5 tm? -117.55 123.19 45.64 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 87' ' ' VAL . 22.7 t -122.56 119.63 58.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.036 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.2 t -137.15 178.75 6.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.611 -172.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 61.08 30.19 19.33 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.691 0.619 . . . . 0.0 111.742 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.528 HD23 HG23 ' A' ' 4' ' ' ILE . 44.3 mt -62.15 126.31 26.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.336 0.589 . . . . 0.0 110.154 -179.772 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.8 mm -120.95 137.13 55.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 25.4 m -130.12 130.03 44.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.764 0.316 . . . . 0.0 111.226 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 70.9 m95 -117.31 141.91 47.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.523 175.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.38 156.3 40.43 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.631 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.465 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 19.6 m -74.98 158.84 32.59 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -54.08 -30.85 49.9 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.047 0.451 . . . . 0.0 111.277 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -73.4 -1.56 18.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.96 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.84 21.37 47.02 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.073 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 37.9 mt-10 -99.95 122.04 52.07 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.6 Cg_exo -58.67 137.9 82.72 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.859 2.373 . . . . 0.0 112.385 -176.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 49' ' ' LEU . 10.9 mt -103.51 146.55 28.36 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.99 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.79 105.87 0.5 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.227 175.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.658 -176.594 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 121.179 0.514 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.52 151.65 27.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.476 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.4 mtmt -131.63 140.49 49.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.078 0.466 . . . . 0.0 110.153 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.488 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -117.19 125.92 6.73 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 174.362 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 54.2 t -108.63 120.84 60.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.818 0.342 . . . . 0.0 110.426 -178.228 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -114.46 140.17 48.93 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.895 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.3 m -99.39 115.03 28.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.152 0.501 . . . . 0.0 110.445 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -119.69 166.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.053 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.404 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 21.6 m -82.11 137.26 35.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.96 -28.54 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.917 177.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.42 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 23.6 mt-10 -56.99 -42.2 79.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.621 176.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 46.1 m-20 -63.08 -47.85 81.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 109.904 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.427 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -63.56 -39.0 93.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.328 177.766 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -69.45 -28.65 66.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.76 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -94.48 12.64 26.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 64.7 36.87 7.92 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.283 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.81 163.74 26.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.038 0.447 . . . . 0.0 110.539 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -130.71 139.34 50.29 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.595 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 83.9 m-85 -121.52 162.04 21.24 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.215 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 75.0 t -122.94 126.54 73.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.99 0.424 . . . . 0.0 111.073 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 48.5 t -106.4 136.89 45.36 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 173.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.477 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -124.36 129.57 50.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.767 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 28' ' ' VAL . 38.9 t -102.27 126.63 56.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.668 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.1 p -117.43 93.58 4.22 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.473 0.654 . . . . 0.0 110.673 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.487 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 24.1 t-80 -99.46 -7.13 26.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.181 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 89' ' ' HIS . 37.6 ptt85 65.08 -11.79 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.476 1.51 . . . . 0.0 112.537 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.423 ' H ' ' C ' ' A' ' 89' ' ' HIS . 16.0 t70 -76.27 -33.95 59.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.467 0.651 . . . . 0.0 110.304 -174.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.89 153.68 37.73 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.564 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.23 -23.63 11.67 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.083 2.522 . . . . 0.0 112.55 -178.391 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.487 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 15.9 m -132.02 114.78 15.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.917 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.487 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 14.3 Cg_endo -56.84 141.15 92.88 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.933 2.422 . . . . 0.0 111.913 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -89.65 127.1 35.87 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.458 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.9 ptpt -108.22 140.76 40.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.359 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 6' ' ' THR . 62.3 mmtt -127.37 139.97 52.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.978 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -101.67 136.99 40.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.709 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 tt -131.38 138.87 52.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.866 0.365 . . . . 0.0 110.956 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.6 t -154.53 149.99 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.581 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.427 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 53.4 tttm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.452 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 . . . . . 0 CA--C 1.519 -0.239 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 31' ' ' LEU . 54.4 mt -60.28 126.93 18.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.36 130.92 52.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.164 0.507 . . . . 0.0 110.673 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -112.56 119.46 38.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.066 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.574 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 58.1 m-85 -119.77 135.37 54.87 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.722 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.4 p -113.67 132.43 55.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.818 0.342 . . . . 0.0 110.533 177.495 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.64 124.79 28.58 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.189 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.31 140.44 58.5 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.775 2.317 . . . . 0.0 111.518 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HB2' HD11 ' A' ' 16' ' ' ILE . 18.2 Cg_endo -59.05 162.03 14.59 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.271 2.647 . . . . 0.0 113.071 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.507 ' O ' HG13 ' A' ' 16' ' ' ILE . 40.7 t -78.73 114.24 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.351 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.548 ' HA ' HD12 ' A' ' 16' ' ' ILE . 32.7 t80 -56.7 -35.32 68.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.568 -171.421 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -44.76 70.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.992 0.425 . . . . 0.0 111.049 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.56 -33.67 76.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.03 -176.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.8 mt -57.85 -40.19 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.909 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -72.36 -39.33 68.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.465 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.14 -48.01 59.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.448 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.7 m -78.26 -12.82 60.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.969 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp 66.24 7.88 5.18 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.046 -176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.9 m -138.41 134.69 34.43 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.993 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.679 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -80.57 165.4 22.13 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.688 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 25.2 m120 -139.76 151.79 46.08 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.708 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 80.9 mt -114.01 119.69 38.05 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.211 -177.139 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.7 m -105.02 123.42 47.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.311 0.577 . . . . 0.0 111.312 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.5 ' HG ' ' HG ' ' A' ' 85' ' ' CYS . 42.2 t -109.83 137.06 48.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.267 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 1.3 tm? -127.5 122.55 33.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.039 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.14 120.95 54.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.744 0.306 . . . . 0.0 110.561 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 t -137.93 178.09 7.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.448 -175.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 59.14 42.01 19.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.564 0.54 . . . . 0.0 112.182 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 4' ' ' ILE . 16.3 mt -71.9 124.06 24.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 175.554 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.423 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.41 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 63.6 t30 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.532 HG21 ' HA3' ' A' ' 68' ' ' GLY . 30.4 mm -119.79 137.31 54.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 176.664 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' THR . 22.6 t -143.28 138.75 29.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.045 -0.662 . . . . 0.0 111.457 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.512 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 86.3 m95 -126.22 143.23 51.22 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.605 177.014 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.39 160.4 43.46 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.487 ' HB2' ' OE1' ' A' ' 47' ' ' GLU . 18.7 m -87.59 160.13 18.3 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -54.36 -37.32 64.81 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.424 ' HB3' ' OE1' ' A' ' 47' ' ' GLU . 10.6 t -85.59 6.61 26.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.016 0.436 . . . . 0.0 110.995 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.93 23.59 24.96 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.547 173.858 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.487 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 3.2 mp0 -84.51 122.12 75.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.234 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.6 136.73 64.69 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.419 2.079 . . . . 0.0 111.72 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -113.68 139.78 48.78 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.645 -176.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.55 106.66 2.23 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.895 177.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 8.9 m . . . . . 0 C--N 1.317 -0.815 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.931 -176.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 p . . . . . 0 C--O 1.24 0.553 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.74 145.27 32.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.184 167.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -131.21 138.25 49.29 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.98 0.419 . . . . 0.0 110.072 -176.087 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.532 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -146.89 136.72 6.3 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 176.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.708 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 5.6 m -116.95 149.94 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 117.319 0.559 . . . . 0.0 111.342 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 51' ' ' THR . . . -114.59 150.39 35.09 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.427 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -98.33 114.73 27.15 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 122.105 0.955 . . . . 0.0 110.063 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.1 t -119.41 153.36 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.628 0 CA-C-N 113.401 -1.727 . . . . 0.0 109.383 -173.513 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -83.98 141.1 31.46 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.5 p -53.16 -33.13 19.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-O 121.057 0.456 . . . . 0.0 109.901 176.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -55.62 -36.64 67.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.423 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -68.15 -51.91 40.62 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.122 0.487 . . . . 0.0 109.974 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.478 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -66.73 -34.96 79.0 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.515 -177.982 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 32.3 t30 -71.73 -22.16 61.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.71 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -101.33 8.88 42.14 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.829 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 64.99 37.91 6.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.25 151.1 13.21 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.48 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -109.06 138.11 45.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.448 172.393 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.478 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.1 m-85 -127.6 156.05 42.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.162 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.533 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.5 t -119.17 127.37 75.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.608 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.512 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 49.9 t -105.47 130.94 53.44 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.547 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -125.54 122.41 36.45 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.552 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.0 t -108.55 127.37 65.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.769 0.319 . . . . 0.0 111.004 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.487 HG22 ' HB3' ' A' ' 95' ' ' PRO . 23.3 p -122.16 108.82 13.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.102 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.413 ' O ' ' CB ' ' A' ' 90' ' ' ARG . 52.3 t-80 -98.43 -50.99 4.11 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.977 -176.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 37.6 ttt-85 128.55 -20.5 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 O-C-N 125.178 1.549 . . . . 0.0 107.735 -163.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.557 ' HB3' HD11 ' A' ' 4' ' ' ILE . 12.2 t70 -73.32 -37.32 66.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.314 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.15 152.14 75.45 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.281 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.32 -23.33 13.38 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.433 2.755 . . . . 0.0 112.86 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 36.7 m -125.59 109.93 25.78 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.547 ' HB2' HG22 ' A' ' 86' ' ' THR . 14.1 Cg_endo -56.8 142.11 92.31 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 123.026 2.484 . . . . 0.0 112.528 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 86' ' ' THR . 41.3 mt-30 -80.94 131.37 35.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.161 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -109.46 127.89 54.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.303 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 57.6 mmtt -122.64 133.74 54.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -178.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.0 m-85 -100.91 132.71 46.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 13.7 tt -126.63 139.02 52.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.099 0.476 . . . . 0.0 111.255 -178.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.1 p -158.02 149.45 21.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.613 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.874 178.672 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 30' ' ' ASN . 33.1 t70 . . . . . 0 CA--C 1.516 -0.348 0 CA-C-O 120.748 0.309 . . . . 0.0 110.426 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 31' ' ' LEU . 66.2 mt -63.13 124.38 17.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.933 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.76 130.81 49.85 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.222 0.534 . . . . 0.0 109.877 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.7 m -114.66 118.29 33.25 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.005 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.69 142.68 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.176 0.513 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -119.29 131.61 55.78 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.122 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 37.1 mm -117.88 124.97 28.34 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.302 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 33.6 Cg_endo -64.35 143.64 83.47 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 122.738 2.292 . . . . 0.0 111.798 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.571 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 44.8 Cg_endo -65.77 152.12 82.49 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.674 2.249 . . . . 0.0 111.825 178.031 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.477 ' O ' HG13 ' A' ' 16' ' ' ILE . 34.3 t -78.23 124.29 27.91 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.645 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.36 -29.55 69.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.409 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.39 77.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.216 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.9 -45.83 76.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.19 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 22' ' ' ALA . 73.2 mt -56.99 -33.09 41.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 121.147 0.499 . . . . 0.0 110.693 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -66.46 -43.77 84.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -76.98 -49.38 15.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.543 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 m -74.14 -19.51 60.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.915 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt 67.44 7.11 5.33 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.249 0.619 . . . . 0.0 111.198 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.7 t -139.17 153.56 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.501 -0.772 . . . . 0.0 108.952 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.551 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -93.67 142.67 27.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.587 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 42.5 m-80 -131.19 112.42 12.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.12 0.486 . . . . 0.0 110.458 -173.731 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.7 mt -78.74 143.36 36.25 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.941 -177.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.483 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 28.0 m -125.59 123.0 38.08 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.336 0.588 . . . . 0.0 110.758 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 36.6 t -114.15 131.96 56.25 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.445 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD23 ' HE3' ' A' ' 67' ' ' LYS . 3.2 tm? -118.91 124.67 47.65 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.54 ' O ' ' HB3' ' A' ' 65' ' ' SER . 14.5 t -120.18 119.74 60.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.5 t -134.04 177.63 7.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.673 -173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 1.1 t30 58.5 45.93 15.72 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.558 0.536 . . . . 0.0 111.447 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.593 HD22 ' CD2' ' A' ' 89' ' ' HIS . 17.7 mt -71.48 146.36 48.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.209 -175.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.502 -171.206 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.608 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.0 mm -120.19 136.83 55.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.4 t -137.3 131.59 32.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.97 0.414 . . . . 0.0 110.382 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.512 ' HD1' HG21 ' A' ' 51' ' ' THR . 62.3 m95 -112.8 149.91 32.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.27 163.71 39.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.178 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 31.9 t -88.13 171.84 9.95 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.835 175.529 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -55.48 -29.94 59.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.137 0.494 . . . . 0.0 111.367 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -73.53 -8.62 56.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.922 0.392 . . . . 0.0 111.108 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.66 16.08 55.52 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.456 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 12.5 pt-20 -94.31 126.97 46.27 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -174.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.26 135.46 62.0 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.012 2.475 . . . . 0.0 113.565 -172.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.497 HD11 ' CD1' ' A' ' 83' ' ' PHE . 9.8 mt -97.37 147.8 23.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.02 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.69 106.51 3.55 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.886 0.851 . . . . 0.0 110.177 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.512 HG21 ' HD1' ' A' ' 41' ' ' TRP . 16.5 m . . . . . 0 C--N 1.31 -1.116 0 CA-C-N 113.908 -1.496 . . . . 0.0 109.382 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.54 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 14.6 m . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 121.273 0.559 . . . . 0.0 111.566 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.99 143.16 35.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 175.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.557 ' HE3' HD23 ' A' ' 27' ' ' LEU . 56.7 mttp -129.74 139.92 51.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.608 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -124.88 123.97 5.22 Favored Glycine 0 N--CA 1.44 -1.075 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 62.0 t -106.93 123.33 61.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.979 0.418 . . . . 0.0 109.971 -177.663 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.587 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -113.46 136.12 53.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.063 -177.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 p -98.16 113.54 25.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.493 -177.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.509 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m -119.47 164.44 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.155 -175.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.477 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 42.5 m -74.99 140.67 43.79 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.451 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -61.54 -32.22 52.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.551 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 5.5 mm-40 -60.22 -33.94 72.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.229 177.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.477 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 4.7 m-20 -62.16 -44.81 95.78 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -74.31 -34.85 63.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.435 -179.733 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.441 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 82.7 m-20 -64.29 -32.54 74.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.756 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -92.56 6.65 46.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.928 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 58.33 38.25 25.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -66.05 166.09 12.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.406 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 101' ' ' SER . 26.6 tt0 -123.27 139.19 54.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.084 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.497 ' CD1' HD11 ' A' ' 49' ' ' LEU . 79.2 m-85 -121.81 163.75 18.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.341 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.467 HG22 ' CD1' ' A' ' 99' ' ' PHE . 89.3 t -128.42 128.08 67.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.474 -176.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.737 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 25.9 p -105.89 142.81 34.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.544 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -123.53 127.31 48.15 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.765 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.485 HG11 HG11 ' A' ' 28' ' ' VAL . 60.3 t -106.47 127.26 61.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.079 -177.21 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -126.84 102.28 6.96 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.318 0.58 . . . . 0.0 109.493 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.734 ' HD1' ' HB2' ' A' ' 91' ' ' ASP . 56.5 t-80 -98.52 -9.99 24.16 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.04 -174.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER 71.07 11.43 6.95 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.831 0.824 . . . . 0.0 109.042 -174.306 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.734 ' HB2' ' HD1' ' A' ' 89' ' ' HIS . 7.0 t70 -92.66 -37.25 12.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.5 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -122.63 155.57 62.71 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.733 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.43 -31.79 10.87 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.811 2.341 . . . . 0.0 112.551 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 92' ' ' LEU . 22.2 p -113.04 110.25 51.57 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.63 -177.198 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.544 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.5 Cg_endo -62.64 141.79 87.15 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.765 2.31 . . . . 0.0 111.892 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.15 136.16 34.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.45 -176.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -107.22 132.61 52.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.212 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.737 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -124.95 140.86 52.54 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.725 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.467 ' CD1' HG22 ' A' ' 84' ' ' VAL . 70.3 m-85 -104.83 141.08 37.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.142 -177.934 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.4 tt -140.5 137.32 36.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.805 0.336 . . . . 0.0 110.602 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 22.8 t -157.89 150.33 22.46 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 1.1 tmmt? . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.336 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 . . . . . 0 CA--C 1.516 -0.334 0 CA-C-O 121.378 0.608 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.531 HG23 HD23 ' A' ' 31' ' ' LEU . 81.9 mt -60.32 122.29 10.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.792 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.6 mt -107.63 132.2 53.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.145 0.497 . . . . 0.0 110.877 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.483 HG22 HG21 ' A' ' 87' ' ' VAL . 33.4 p -107.66 127.11 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.268 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -124.73 152.8 43.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.709 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.0 p -134.12 138.29 45.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.574 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -117.9 123.06 29.93 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.606 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.487 ' HA ' HD11 ' A' ' 100' ' ' ILE . 72.1 Cg_endo -75.32 140.15 24.27 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.129 2.552 . . . . 0.0 111.819 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HG2' HD11 ' A' ' 16' ' ' ILE . 73.7 Cg_endo -70.86 150.56 61.69 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.289 1.993 . . . . 0.0 111.754 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -78.73 144.7 34.99 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.114 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.39 -31.33 71.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.089 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.03 93.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.312 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.68 -47.24 84.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.974 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.407 HD11 ' HG2' ' A' ' 11' ' ' PRO . 57.6 mt -63.35 -34.14 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.497 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -73.28 -45.69 54.23 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.758 -175.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.0 -49.37 37.59 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.669 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.8 m -80.38 -15.83 55.91 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.158 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.8 mttp 62.16 19.6 11.04 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.299 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.7 m -141.09 154.72 46.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.372 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.764 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -104.53 162.39 13.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -146.84 145.91 30.03 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.559 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 69.4 mt -107.17 128.01 54.02 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.233 -177.134 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.7 m -115.54 126.8 54.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.163 0.506 . . . . 0.0 111.098 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.671 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 32.7 t -126.62 138.45 53.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.525 HD12 ' HG2' ' A' ' 67' ' ' LYS . 2.5 tt -132.34 135.82 46.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.235 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' SER . 42.1 t -118.18 125.59 74.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.372 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.4 m -127.94 176.38 7.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.295 -176.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 59.66 41.34 18.79 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.101 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 HG23 ' A' ' 4' ' ' ILE . 34.7 mt -80.49 126.85 31.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.549 177.39 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.634 -178.149 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.8 m120 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.505 HG21 ' HA3' ' A' ' 68' ' ' GLY . 20.6 mm -119.36 134.97 61.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 172.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.7 t -143.34 126.99 17.0 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.069 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 87.7 m95 -105.15 148.35 26.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.2 0.524 . . . . 0.0 110.382 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.56 158.23 40.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.507 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.41 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 32.3 t -75.68 162.58 28.11 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -58.09 -25.16 60.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.258 0.551 . . . . 0.0 110.296 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.3 m -72.95 -8.56 56.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.133 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.17 19.2 43.3 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.283 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -100.03 123.57 46.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.516 0.198 . . . . 0.0 110.868 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.08 141.69 96.77 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.317 2.678 . . . . 0.0 113.276 -176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.9 mt -113.21 147.38 37.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.168 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 21.9 tt0 -56.78 107.52 0.4 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.587 176.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.299 178.742 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.45 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 2.0 m . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.486 0.66 . . . . 0.0 111.975 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -108.27 149.3 28.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.071 174.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.525 ' HG2' HD12 ' A' ' 27' ' ' LEU . 28.9 mtpp -131.69 139.37 49.02 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.36 129.2 4.61 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.926 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 42.1 t -115.23 132.06 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.788 0.328 . . . . 0.0 110.714 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.32 151.65 35.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.167 177.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -99.33 120.74 40.06 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.592 0.71 . . . . 0.0 110.38 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.764 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.0 t -124.25 151.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.083 -174.945 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -88.57 153.27 21.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -60.87 -36.75 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.191 0.52 . . . . 0.0 109.98 -177.585 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 9.9 mm-40 -57.54 -33.88 68.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.778 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.21 -48.33 80.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.535 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -68.78 -36.24 78.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.756 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 87.6 m-20 -64.24 -34.35 77.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.974 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -87.53 7.12 30.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.666 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 80' ' ' ARG . 23.2 mmt180 56.58 37.81 29.11 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.76 178.311 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -63.5 159.08 19.31 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.651 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -111.63 138.07 48.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.842 175.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.41 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 68.5 m-85 -122.42 154.26 37.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.29 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.511 HG22 ' CD1' ' A' ' 99' ' ' PHE . 86.2 t -123.59 128.19 74.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -173.521 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 28.9 p -106.15 140.27 39.38 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.662 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.477 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -119.19 127.02 52.91 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.773 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.483 HG21 HG22 ' A' ' 6' ' ' THR . 58.6 t -110.26 133.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.817 -178.056 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.0 p -139.06 100.67 4.09 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.176 0.512 . . . . 0.0 111.066 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.521 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 50.2 t60 -98.4 -8.19 27.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.03 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 52.2 ttt180 79.7 -27.6 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.782 0.676 . . . . 0.0 110.738 -176.183 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -71.17 -33.11 69.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.087 0.47 . . . . 0.0 110.75 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 92' ' ' LEU . 0.9 OUTLIER -87.89 146.44 38.78 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-O 121.203 0.525 . . . . 0.0 110.752 177.489 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.62 -19.54 11.31 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.288 2.658 . . . . 0.0 112.813 -175.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 20.1 m -141.25 132.52 13.53 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.555 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 27.3 Cg_exo -61.85 140.99 88.38 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.497 2.131 . . . . 0.0 111.514 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -92.75 128.56 38.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.903 0.382 . . . . 0.0 110.456 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.477 ' HG2' HG23 ' A' ' 86' ' ' THR . 56.5 mtpt -106.11 141.62 37.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.679 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 30.3 mmtm -129.85 138.98 51.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.292 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.511 ' CD1' HG22 ' A' ' 84' ' ' VAL . 15.7 m-30 -100.98 137.56 39.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.86 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.6 tt -130.48 139.45 51.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.958 0.409 . . . . 0.0 110.722 177.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.5 p -157.38 148.7 21.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.219 176.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.463 ' HB2' ' NE1' ' A' ' 77' ' ' TRP . 27.1 tptp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.687 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 CA--C 1.518 -0.258 0 CA-C-O 121.152 0.501 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.581 HG23 HD23 ' A' ' 31' ' ' LEU . 84.0 mt -63.29 135.95 26.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.437 174.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.6 mt -104.54 130.79 52.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.929 0.395 . . . . 0.0 110.29 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.0 p -116.86 122.57 44.74 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.14 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -121.1 133.92 55.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.48 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 p -112.14 134.48 53.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.22 176.896 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.51 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 34.0 mm -117.42 119.93 33.89 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.574 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.51 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 18.1 Cg_endo -58.31 139.59 91.12 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.996 2.464 . . . . 0.0 111.802 173.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.523 ' HB2' HD11 ' A' ' 16' ' ' ILE . 43.6 Cg_endo -65.96 153.14 79.34 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 123.118 2.546 . . . . 0.0 112.905 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.499 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.0 t -81.09 121.41 26.06 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 178.152 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' A' ' 16' ' ' ILE . 51.8 t80 -62.83 -34.08 76.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.105 -173.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.413 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -61.98 -46.41 89.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.449 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.25 -38.86 88.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.568 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.585 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.6 mt -58.9 -40.68 80.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.52 176.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -73.6 -43.56 59.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.073 -176.227 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -62.86 -48.71 77.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.952 -177.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.2 p -86.94 -13.95 43.22 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.176 0.512 . . . . 0.0 111.07 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.81 27.06 16.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.049 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.4 m -139.08 134.0 32.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.144 174.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.585 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -87.51 142.65 27.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 39.2 m-80 -126.55 118.41 24.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.009 0.433 . . . . 0.0 110.091 -173.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.546 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 86.9 mt -82.82 139.15 33.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.959 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 30.2 m -124.9 120.62 32.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.477 0.656 . . . . 0.0 110.937 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 42.5 t -121.48 136.67 54.94 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.413 178.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HG ' ' OG ' ' A' ' 65' ' ' SER . 2.7 tt -131.81 130.75 42.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.531 HG11 HG21 ' A' ' 87' ' ' VAL . 12.8 t -120.76 119.5 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.687 -176.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.1 p -130.86 177.13 7.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.043 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.2 45.28 17.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.298 0.57 . . . . 0.0 111.189 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.581 HD23 HG23 ' A' ' 4' ' ' ILE . 25.4 mt -78.16 110.5 13.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.352 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.407 -172.426 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.5 m120 . . . . . 0 N--CA 1.441 -0.912 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.646 HG21 ' HA3' ' A' ' 68' ' ' GLY . 16.0 mm -119.21 134.79 61.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 175.446 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.411 ' HB3' ' O ' ' A' ' 86' ' ' THR . 23.2 t -141.26 129.89 22.75 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 119.666 -0.814 . . . . 0.0 111.508 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.579 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -105.48 146.88 28.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.687 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.51 164.19 38.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.701 179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.8 p -75.52 170.6 15.82 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -58.45 -28.51 65.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.139 0.495 . . . . 0.0 110.818 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.0 m -75.62 -8.21 56.22 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.219 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.7 21.43 43.49 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.347 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 0.8 OUTLIER -96.64 122.9 55.88 Favored Pre-proline 0 N--CA 1.443 -0.775 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.69 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 38.1 Cg_exo -59.78 139.63 89.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 123.024 2.483 . . . . 0.0 113.875 -172.307 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 7.1 mt -105.74 145.02 31.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.604 174.904 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -63.12 105.8 0.76 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.335 0.588 . . . . 0.0 110.325 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.42 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.2 m . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.269 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.483 ' OG ' ' HG ' ' A' ' 27' ' ' LEU . 33.0 t . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 120.79 0.328 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.431 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.66 155.74 21.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.482 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.417 ' HG2' HD12 ' A' ' 27' ' ' LEU . 46.7 mttp -129.72 139.44 51.33 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 176.032 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.646 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -121.93 118.76 3.8 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.546 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 58.5 t -107.84 122.95 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.748 0.308 . . . . 0.0 110.451 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.33 141.06 48.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.902 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -98.87 114.6 27.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.28 0.562 . . . . 0.0 110.326 -177.026 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.5 m -119.73 166.77 13.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.774 -177.267 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.4 m -79.13 144.89 34.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.905 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 t -57.24 -30.85 36.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 173.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.96 -39.58 90.1 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.473 177.558 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -61.81 -42.35 98.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.558 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -73.02 -39.19 66.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 179.296 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -68.9 -23.95 64.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.639 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -98.02 16.8 19.97 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 17.4 mmt180 55.59 36.71 27.72 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.969 173.556 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -71.98 157.59 37.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.373 0.606 . . . . 0.0 111.958 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.558 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.4 mp0 -109.23 139.11 44.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.433 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.37 151.81 45.62 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.219 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.9 t -122.2 122.74 67.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.399 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 20.6 p -105.6 133.37 50.45 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.548 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -126.4 128.38 46.93 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -178.076 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 HG11 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -119.84 127.41 75.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.039 0.447 . . . . 0.0 112.155 -174.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.0 m -112.18 108.51 17.79 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.191 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -101.21 -8.81 21.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.091 177.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 74.15 -3.84 2.43 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.333 0.587 . . . . 0.0 110.317 -175.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.548 ' HB3' HD11 ' A' ' 4' ' ' ILE . 5.5 t70 -73.23 -36.32 66.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.569 -177.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -122.61 154.16 63.12 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.577 -176.563 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -68.08 -20.69 43.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.254 2.636 . . . . 0.0 112.476 -176.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.505 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 13.7 m -129.04 111.37 18.4 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.259 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.548 ' HB2' HG22 ' A' ' 86' ' ' THR . 11.8 Cg_endo -55.21 148.45 49.76 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.722 2.281 . . . . 0.0 110.919 174.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' THR . 40.9 mt-30 -90.8 127.42 36.34 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.759 -171.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 15.9 ptmt -110.14 129.92 55.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.304 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.726 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 67.6 mmtt -122.92 140.9 52.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.686 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -100.68 122.99 44.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.368 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.9 tt -122.86 139.29 50.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 3.7 p -157.47 148.87 21.82 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.245 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 49.5 tttp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.098 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 CA--C 1.517 -0.322 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.468 HG23 HD23 ' A' ' 31' ' ' LEU . 59.6 mt -66.95 120.5 14.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.391 0.432 . . . . 0.0 110.237 -176.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.5 mt -108.77 134.41 51.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.17 0.509 . . . . 0.0 111.192 -175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.513 ' HB ' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -107.39 127.72 53.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.112 -177.904 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PHE . . . . . 0.54 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 94.9 m-85 -127.34 143.15 51.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -119.63 137.86 53.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.742 0.306 . . . . 0.0 110.664 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.17 123.46 30.05 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.995 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HA ' HD11 ' A' ' 100' ' ' ILE . 61.1 Cg_endo -70.91 148.73 58.22 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 123.124 2.549 . . . . 0.0 112.066 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.25 149.33 81.38 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.585 2.19 . . . . 0.0 111.75 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 16' ' ' ILE . 2.8 t -103.27 143.99 31.93 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.035 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -58.23 -30.59 66.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.458 -172.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -67.75 -44.18 78.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.782 0.325 . . . . 0.0 110.314 175.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.82 -45.95 91.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.16 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 12' ' ' SER . 51.9 mt -61.01 -29.89 46.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.363 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.95 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -72.3 -43.92 63.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.109 0.48 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.3 mm? -67.27 -49.53 63.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.262 -176.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 p -93.82 0.84 56.46 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 87.2 tttt 69.51 -48.9 0.61 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.4 0.68 . . . . 0.0 111.165 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 13.8 m -89.38 151.21 22.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.916 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.3 155.88 24.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.209 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -129.86 126.41 37.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.064 0.459 . . . . 0.0 110.588 -176.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.412 HD22 HD13 ' A' ' 100' ' ' ILE . 52.7 mt -89.39 138.45 31.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.81 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.559 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 19.2 m -120.8 129.2 53.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.018 0.437 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 47.0 t -109.75 137.38 47.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.169 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 2.8 tm? -126.34 123.73 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 87' ' ' VAL . 15.4 t -123.89 119.63 57.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.9 p -133.71 177.39 7.75 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -173.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.7 m120 59.46 40.74 20.32 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.428 177.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.468 HD23 HG23 ' A' ' 4' ' ' ILE . 58.6 mt -64.1 127.43 31.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.187 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.651 -179.326 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.511 HG21 ' HA3' ' A' ' 68' ' ' GLY . 27.8 mm -121.86 151.91 25.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -177.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 37.3 m -149.98 123.74 9.23 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.084 -0.385 . . . . 0.0 111.109 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 67.4 m95 -107.76 144.87 34.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.174 0.512 . . . . 0.0 111.246 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.76 157.07 34.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.067 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.679 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 14.7 m -88.26 162.65 16.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.046 0.45 . . . . 0.0 109.926 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.3 -25.05 8.52 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.891 -1.05 . . . . 0.0 113.821 -170.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -88.1 -0.78 57.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.857 0.361 . . . . 0.0 111.403 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.16 22.16 28.18 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.324 -0.465 . . . . 0.0 112.061 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.679 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 8.2 pt-20 -100.4 128.76 29.51 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.731 0.301 . . . . 0.0 110.595 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 35.7 Cg_exo -61.13 141.55 94.08 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.33 2.687 . . . . 0.0 113.77 -173.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.502 HD11 ' CD1' ' A' ' 83' ' ' PHE . 8.5 mt -108.19 147.71 30.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.959 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 4.2 mp0 -62.39 106.2 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.632 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.321 -0.637 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.801 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.567 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 17.3 m . . . . . 0 CA--C 1.533 0.308 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.69 146.0 31.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.861 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 55.6 mtpt -132.48 140.76 48.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.462 -175.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.511 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -129.33 139.37 10.91 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 53.6 t -114.44 124.5 71.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.0 0.429 . . . . 0.0 110.79 -174.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -115.69 134.64 54.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.83 177.834 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.8 m -98.92 123.38 43.16 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.081 0.467 . . . . 0.0 110.166 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' SER . 4.0 m -122.03 165.32 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.929 -175.836 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.1 t -86.69 150.06 24.45 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 t -63.82 -24.28 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -65.14 -36.53 84.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.731 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.451 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 59.7 m-20 -68.18 -44.67 75.4 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.442 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -69.18 -35.28 76.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.478 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -70.54 -27.7 64.35 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.587 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -92.94 7.67 43.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.918 0.39 . . . . 0.0 110.326 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.9 mtt-85 58.34 37.49 25.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.28 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 53.3 mtpt -67.1 156.48 36.03 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.977 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.51 139.23 43.55 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.273 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.502 ' CD1' HD11 ' A' ' 49' ' ' LEU . 64.8 m-85 -124.71 150.62 45.98 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.128 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 94.7 t -125.27 131.47 72.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.752 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 30.6 p -106.31 126.28 52.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.48 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.569 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 1.4 p -112.05 137.64 49.81 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.658 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 28' ' ' VAL . 44.7 t -116.59 127.42 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.603 -175.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 95' ' ' PRO . 1.4 p -119.02 94.22 4.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.692 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 1.3 t60 -85.34 -50.78 7.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.33 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.692 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 3.2 tmm_? 151.69 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.758 1.286 . . . . 0.0 108.307 -176.737 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -71.37 -30.41 66.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.662 -1.154 . . . . 0.0 112.177 -167.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.32 148.23 43.41 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-O 121.105 0.479 . . . . 0.0 111.067 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -78.61 -26.86 5.47 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.271 2.647 . . . . 0.0 111.96 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.6 p -118.39 122.3 30.28 Favored Pre-proline 0 N--CA 1.445 -0.684 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.518 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.569 ' HB2' ' HB ' ' A' ' 86' ' ' THR . 18.7 Cg_endo -60.5 140.72 92.83 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.198 1.932 . . . . 0.0 111.997 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.544 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.9 pt20 -78.94 135.11 36.86 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.648 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -113.31 128.01 56.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.315 0.579 . . . . 0.0 111.782 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.513 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 6.2 tmtt? -121.98 140.91 51.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.178 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -100.35 147.55 25.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.836 0.35 . . . . 0.0 111.101 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.6 tt -133.77 138.55 50.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.455 176.427 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 56.9 p -158.3 149.94 21.34 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.65 -0.69 . . . . 0.0 110.26 179.254 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 120.689 0.281 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.54 HG23 HD23 ' A' ' 31' ' ' LEU . 69.3 mt -60.39 121.81 9.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.308 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 83.4 mt -108.95 140.32 42.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.003 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.528 ' HB ' HG21 ' A' ' 87' ' ' VAL . 2.5 t -134.21 125.41 27.76 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.202 0.525 . . . . 0.0 110.517 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -121.52 141.9 50.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.483 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.465 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.7 p -113.55 132.44 55.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.012 0.434 . . . . 0.0 111.48 -178.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.44 124.34 29.07 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.089 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -77.91 145.0 22.08 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 123.153 2.569 . . . . 0.0 112.267 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.0 147.76 49.72 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 122.453 2.102 . . . . 0.0 111.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.91 155.17 16.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.096 -176.378 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -56.47 -43.97 80.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.555 0.217 . . . . 0.0 111.487 -173.511 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -45.89 92.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.149 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.22 -40.06 95.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.045 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.36 -30.58 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.704 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -71.85 -43.96 64.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.853 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.45 -48.15 61.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.734 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.5 p -80.91 -13.09 59.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.54 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 60.16 21.26 10.56 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.865 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.3 m -137.82 137.75 38.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.349 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.534 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -97.12 148.91 22.56 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.4 p30 -157.73 127.73 6.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.001 0.429 . . . . 0.0 110.484 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.524 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -84.41 146.94 27.39 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.063 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.7 m -124.22 120.97 33.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.169 0.509 . . . . 0.0 111.154 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.576 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.4 t -113.27 137.69 51.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' A' ' 67' ' ' LYS . 1.2 tt -131.9 138.08 48.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.854 0.359 . . . . 0.0 110.629 175.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.622 HG22 ' H ' ' A' ' 66' ' ' ALA . 4.4 m -115.03 147.1 18.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.539 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.3 p -143.19 175.25 10.02 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.708 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 59.1 31.99 21.77 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.54 HD23 HG23 ' A' ' 4' ' ' ILE . 49.5 mt -71.34 118.36 14.04 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.111 0 CA-C-O 121.163 0.506 . . . . 0.0 110.573 -179.557 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 63.5 t30 . . . . . 0 N--CA 1.446 -0.661 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.644 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.1 mm -120.87 135.23 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 t -138.73 147.46 42.72 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -123.7 149.3 45.67 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.372 177.066 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -147.07 150.93 36.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 m -74.73 150.6 39.38 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -52.59 -24.7 8.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.6 p -73.5 -6.72 48.23 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.175 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.24 19.92 37.39 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.99 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.4 mt-10 -100.02 121.5 53.74 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 24.3 Cg_exo -63.55 139.6 71.01 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.826 2.351 . . . . 0.0 112.93 -175.612 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.5 mt -107.07 145.43 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.596 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -72.0 106.85 4.44 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.929 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.44 -176.334 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 32.7 t . . . . . 0 N--CA 1.448 -0.563 0 CA-C-O 120.977 0.418 . . . . 0.0 111.963 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.622 ' H ' HG22 ' A' ' 28' ' ' VAL . . . -132.73 155.93 47.96 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.236 170.796 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 27' ' ' LEU . 29.5 mtpp -131.93 140.18 48.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.644 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.95 132.51 5.76 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.354 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 60.9 t -116.53 133.33 63.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.896 0.379 . . . . 0.0 110.525 -177.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.06 139.33 49.96 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.611 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.3 m -97.69 119.0 35.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.005 0.431 . . . . 0.0 110.544 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.534 HG23 ' HB3' ' A' ' 22' ' ' ALA . 11.7 m -130.49 166.53 27.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.859 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.73 150.83 36.23 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.408 HG12 ' ND2' ' A' ' 78' ' ' ASN . 24.2 t -61.0 -32.98 53.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.73 0.776 . . . . 0.0 109.151 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -56.85 -38.81 73.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.94 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.08 -41.08 91.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 -175.436 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -34.31 62.71 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.673 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.408 ' ND2' HG12 ' A' ' 74' ' ' VAL . 69.8 m-20 -69.91 -20.38 63.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.656 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -102.3 8.16 40.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.023 0.439 . . . . 0.0 110.772 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 59.74 38.12 21.82 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.753 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -63.58 164.09 10.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.094 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 42.1 mp0 -107.64 137.17 46.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.602 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 100' ' ' ILE . 60.0 m-85 -129.58 148.24 51.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.875 174.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.609 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 2.6 p -133.19 135.12 57.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.4 p -104.74 142.92 33.85 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.111 0.481 . . . . 0.0 110.808 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -113.96 130.22 56.54 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.732 176.237 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.528 HG21 ' HB ' ' A' ' 6' ' ' THR . 59.0 t -104.64 127.15 59.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.783 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 m -127.47 94.5 4.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.424 0.63 . . . . 0.0 110.726 -173.396 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.457 ' C ' ' H ' ' A' ' 91' ' ' ASP . 1.4 t60 -99.54 -10.84 21.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.045 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.89 -6.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.692 0.758 . . . . 0.0 109.552 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 89' ' ' HIS . 19.8 t70 -72.82 -29.43 63.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.32 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -118.57 154.47 52.46 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.319 178.843 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.64 -20.33 17.89 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.118 2.545 . . . . 0.0 112.937 -177.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 52.1 p -132.13 118.57 16.32 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 18.6 Cg_endo -58.22 141.11 96.46 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.749 2.299 . . . . 0.0 111.362 177.79 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.521 ' O ' ' HA ' ' A' ' 86' ' ' THR . 45.4 mt-30 -83.9 149.71 26.18 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.636 -177.094 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 28.3 mtpp -125.74 137.31 53.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 -176.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 71.3 mmtt -129.9 133.96 47.19 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -101.23 124.41 46.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.33 -174.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.529 HG22 ' O ' ' A' ' 83' ' ' PHE . 13.0 tt -122.0 141.3 42.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.896 0.379 . . . . 0.0 111.15 -178.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.505 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 22.8 p -156.86 149.53 23.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.469 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.921 -0.561 . . . . 0.0 109.489 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 120.67 0.272 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.499 HG23 HD23 ' A' ' 31' ' ' LEU . 28.2 mt -62.18 121.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.591 -176.453 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.5 mt -115.49 132.83 56.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.1 t -121.31 130.54 53.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -125.0 146.65 49.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.519 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.1 p -116.41 137.79 51.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.061 0.458 . . . . 0.0 111.12 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.516 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -117.89 126.6 27.18 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.974 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HA ' HD11 ' A' ' 100' ' ' ILE . 96.0 Cg_endo -78.7 148.36 22.69 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 123.048 2.499 . . . . 0.0 112.55 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -77.51 150.16 27.91 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.601 2.201 . . . . 0.0 111.506 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.7 t -88.97 149.14 23.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.512 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.3 -43.31 71.01 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -60.97 -46.26 91.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.421 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.92 -37.15 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.176 -177.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 12' ' ' SER . 71.0 mt -61.46 -36.92 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.079 0.466 . . . . 0.0 110.434 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -72.22 -43.82 63.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.187 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 14' ' ' ALA . 10.8 mp -66.92 -48.45 68.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.235 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -75.51 -12.81 60.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.476 -178.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 70.79 -10.65 0.71 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.298 0.639 . . . . 0.0 111.131 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 19' ' ' SER . 10.0 p -138.72 147.38 42.65 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.233 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.599 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.08 156.78 19.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 31.1 m-80 -139.42 116.84 11.3 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.639 -171.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.593 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.43 144.1 44.43 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 174.587 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.516 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 39.1 m -125.27 124.21 41.16 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.086 0.47 . . . . 0.0 110.415 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 26.2 t -112.1 136.93 50.86 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.818 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -125.08 122.68 37.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 65' ' ' SER . 24.3 t -121.98 126.42 74.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.7 m -139.14 176.39 8.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.383 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.0 m120 57.32 50.61 11.23 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.86 0.725 . . . . 0.0 111.242 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD23 HG23 ' A' ' 4' ' ' ILE . 65.2 mt -74.66 149.55 39.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.742 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.9 -177.53 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 . . . . . 0 C--O 1.234 0.252 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.657 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.7 mm -122.14 137.63 55.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 t -136.26 143.77 44.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.685 0.279 . . . . 0.0 110.369 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.411 ' CH2' ' HB3' ' A' ' 24' ' ' LEU . 66.7 m95 -129.15 145.82 51.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.981 0.419 . . . . 0.0 110.785 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.78 139.82 17.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.591 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.542 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 29.5 t -66.36 155.26 37.86 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.117 0.484 . . . . 0.0 110.387 174.515 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -62.89 -24.1 67.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.185 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.409 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m -76.67 -3.77 39.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.051 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.83 21.7 38.78 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.755 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 21.5 mt-10 -92.67 121.1 66.8 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 17.1 Cg_exo -66.12 134.23 35.96 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.932 1.755 . . . . 0.0 111.419 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.896 HD12 ' HB1' ' A' ' 70' ' ' ALA . 1.7 mm? -102.68 141.48 35.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.302 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -92.01 107.4 19.18 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.656 176.518 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.0 m . . . . . 0 C--N 1.319 -0.732 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.832 -174.563 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 1.4 m . . . . . 0 N--CA 1.445 -0.689 0 CA-C-O 121.515 0.674 . . . . 0.0 112.305 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.54 149.81 29.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.064 164.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 39.5 mtpt -131.94 141.24 49.26 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.657 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.63 131.66 5.59 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.6 -177.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -122.93 124.13 69.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.989 0.423 . . . . 0.0 110.632 -177.139 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.896 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -116.36 147.38 41.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.351 -176.115 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -104.85 123.64 48.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.988 0.423 . . . . 0.0 111.309 -172.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.607 HG12 HD11 ' A' ' 49' ' ' LEU . 6.4 m -125.38 164.4 24.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.281 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.4 t -82.21 153.72 25.8 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.47 -33.75 52.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.154 0.502 . . . . 0.0 110.256 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 7.8 mm-40 -59.93 -33.34 71.76 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.863 -179.191 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 15.6 m-20 -64.55 -42.43 95.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.436 0.636 . . . . 0.0 109.387 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.0 OUTLIER -74.03 -35.44 64.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.546 179.071 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 69.3 m-20 -64.23 -33.42 75.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.341 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -90.72 8.23 35.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.112 0.482 . . . . 0.0 110.663 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 54.5 38.28 29.42 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.345 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 57.3 mtpt -66.36 159.81 26.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.751 175.763 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -118.08 141.22 48.71 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.972 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 96.6 m-85 -120.04 151.57 38.81 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.224 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.9 t -121.42 129.41 75.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.583 -173.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.618 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 45.1 t -105.77 122.39 46.0 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.496 -0.482 . . . . 0.0 109.714 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.8 112.2 25.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.185 0.517 . . . . 0.0 110.701 176.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.43 ' HB ' ' CG ' ' A' ' 96' ' ' GLN . 43.2 t -97.53 125.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.126 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.5 m -118.46 112.81 20.44 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.619 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 7.3 t-160 -97.98 -50.4 4.42 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.058 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 42.4 ttm180 144.89 -33.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 O-C-N 125.396 1.685 . . . . 0.0 109.947 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.479 ' OD1' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -72.04 -35.19 69.27 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.959 -168.941 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.64 146.05 32.39 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 121.426 0.631 . . . . 0.0 111.301 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.14 -19.24 26.42 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 123.54 2.827 . . . . 0.0 112.466 -174.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 24.0 t -144.13 135.54 12.69 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.74 141.4 95.61 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.047 2.498 . . . . 0.0 112.396 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.43 ' CG ' ' HB ' ' A' ' 87' ' ' VAL . 3.5 pt20 -81.42 133.25 35.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.818 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.3 ptpt -114.82 142.71 46.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.304 0.574 . . . . 0.0 111.707 -175.292 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 32.7 mmtm -129.73 140.0 51.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.232 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CD1' HG22 ' A' ' 84' ' ' VAL . 79.3 m-85 -101.36 133.45 45.94 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.035 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.4 tt -128.68 136.3 60.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.996 0.426 . . . . 0.0 111.182 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.3 p -158.74 146.72 18.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.074 176.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.633 -176.484 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.6 HG23 HD22 ' A' ' 31' ' ' LEU . 68.1 mt -60.37 129.08 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 169.182 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.3 mt -104.1 128.82 51.76 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.156 -171.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.412 HG23 ' HD3' ' A' ' 98' ' ' LYS . 4.1 t -120.3 129.31 53.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.717 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -131.13 141.98 50.19 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.738 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 p -113.08 133.63 54.91 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.848 176.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.3 mp -116.58 124.8 29.01 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.051 -175.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.507 ' HA ' HD11 ' A' ' 100' ' ' ILE . 52.5 Cg_endo -69.57 139.1 40.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.694 2.262 . . . . 0.0 111.687 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 55.7 Cg_endo -65.82 144.17 76.35 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.886 2.39 . . . . 0.0 111.837 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.1 m -85.64 148.59 25.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.641 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -54.71 -42.38 71.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.727 0.24 . . . . 0.0 111.275 -173.302 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -57.81 -45.1 86.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.325 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.83 -42.19 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.85 0.357 . . . . 0.0 110.817 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 21' ' ' SER . 62.1 mt -66.15 -38.82 82.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.661 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -74.03 -43.25 58.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.12 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -64.25 -47.7 78.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.727 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 78.6 p -85.98 -12.31 50.71 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.233 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 32.7 mmtp 65.47 17.43 10.95 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.742 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 23.1 m -139.13 147.21 41.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.394 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -92.04 136.72 32.95 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -114.17 122.95 48.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.635 -173.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 83.4 mt -85.3 125.4 32.89 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.668 177.376 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.9 m -113.64 123.98 51.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.314 0.578 . . . . 0.0 111.434 -176.077 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.546 ' HB3' HD12 ' A' ' 39' ' ' ILE . 18.2 t -124.38 137.05 54.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.656 176.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.51 124.22 26.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.1 t -119.2 129.92 74.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.5 p -143.19 177.37 8.45 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.228 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 15.2 m120 62.53 50.33 3.64 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.706 0.765 . . . . 0.0 109.772 174.322 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.6 HD22 HG23 ' A' ' 4' ' ' ILE . 0.9 OUTLIER -74.56 65.9 1.34 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.869 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.553 0 CA-C-N 113.641 -1.618 . . . . 0.0 109.883 177.526 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.67 ' N ' ' HB ' ' A' ' 87' ' ' VAL . 63.7 t30 . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.575 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.7 mm -122.9 130.47 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 C-N-CA 118.77 -1.172 . . . . 0.0 109.794 169.4 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.8 t -155.53 121.88 5.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.418 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 78.0 m95 -103.04 142.27 34.39 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.447 0.641 . . . . 0.0 111.663 -174.052 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.05 164.97 36.11 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.116 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.48 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 86.9 p -82.17 168.39 17.74 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 177.685 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -63.7 -22.82 67.1 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.292 0.567 . . . . 0.0 110.259 174.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -87.43 -5.49 58.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.222 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.36 22.37 29.59 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.793 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 6.5 pt-20 -93.09 133.14 29.21 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 117.449 0.624 . . . . 0.0 109.433 176.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 16.3 Cg_exo -67.8 136.52 38.98 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.689 2.259 . . . . 0.0 112.306 -177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 49' ' ' LEU . 11.2 mt -109.02 140.83 42.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.785 178.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.35 107.22 0.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.475 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 7.8 m . . . . . 0 C--N 1.313 -0.988 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.745 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.163 0.506 . . . . 0.0 112.193 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.26 135.35 50.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.076 168.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -131.14 138.88 49.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.575 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -144.89 141.22 9.77 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 48.0 t -123.67 133.74 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.629 0.252 . . . . 0.0 110.739 -174.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.495 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -116.15 142.61 46.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 p -100.0 115.46 29.75 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.956 0.408 . . . . 0.0 111.175 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.554 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.9 m -119.44 166.47 13.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.867 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.1 t -81.02 151.89 28.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.24 -24.99 36.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.86 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.71 -34.76 77.52 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.987 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.41 -49.75 76.58 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.453 0.644 . . . . 0.0 109.778 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.579 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -67.78 -34.26 76.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.753 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -68.97 -30.37 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.26 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -92.93 8.58 39.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.325 . . . . 0.0 110.602 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 59.89 36.76 21.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.475 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -63.41 154.67 31.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.298 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 100' ' ' ILE . 25.6 tt0 -118.27 139.31 51.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.558 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 87.5 m-85 -122.64 162.85 21.13 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.49 -176.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.582 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.7 t -131.35 126.35 58.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.984 -175.684 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 45.9 t -111.44 123.51 50.36 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -110.68 125.62 53.65 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.67 ' HB ' ' N ' ' A' ' 38' ' ' ASN . 1.6 m -107.23 145.63 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.152 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.233 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.469 ' H ' ' HB3' ' A' ' 38' ' ' ASN . 2.6 p -143.45 81.2 1.7 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.521 0.676 . . . . 0.0 112.537 -164.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 6.2 t-80 -82.63 -9.15 59.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.54 -178.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.14 21.07 12.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -170.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -84.46 -33.48 23.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.369 -177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.414 ' H ' HD12 ' A' ' 92' ' ' LEU . 0.3 OUTLIER -136.53 163.11 52.19 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.167 -179.399 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.23 -31.13 14.89 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.51 2.14 . . . . 0.0 112.651 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.467 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 3.9 p -109.5 102.49 49.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.474 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.467 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 37.9 Cg_endo -64.11 152.38 81.31 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 123.198 2.599 . . . . 0.0 111.666 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 86' ' ' THR . 35.6 mt-30 -95.82 130.51 42.73 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.052 -175.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -105.78 132.85 51.41 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.893 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.582 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 3.5 mmmp? -114.52 137.51 51.76 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.544 -178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -101.28 138.85 37.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.811 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.507 HD11 ' HA ' ' A' ' 10' ' ' PRO . 11.4 tt -144.24 137.64 23.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 p -157.51 149.56 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.838 0.351 . . . . 0.0 111.347 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 21.5 tptm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.028 177.526 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 120.945 0.402 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.416 HG23 ' CD1' ' A' ' 31' ' ' LEU . 69.4 mt -66.97 122.26 17.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.681 -174.291 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -105.62 135.3 47.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.395 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.509 HG23 ' HE2' ' A' ' 98' ' ' LYS . 4.3 t -125.9 130.16 50.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.271 0.558 . . . . 0.0 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -126.6 136.41 52.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.808 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 p -113.75 132.18 55.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.035 0.445 . . . . 0.0 111.391 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -119.21 126.0 27.29 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.203 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.84 145.79 36.85 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.844 2.362 . . . . 0.0 111.815 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -64.21 151.54 84.96 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.5 2.134 . . . . 0.0 111.928 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 p -97.33 151.6 19.75 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.817 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -54.04 -43.45 70.19 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.692 0.282 . . . . 0.0 111.489 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.456 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.09 -46.35 84.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.125 -178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -64.66 -41.24 96.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.059 -176.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.75 -36.61 76.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.709 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.45 -45.39 54.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.051 0.453 . . . . 0.0 111.099 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.5 mm? -67.24 -48.28 68.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -74.01 -20.25 60.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.13 0.49 . . . . 0.0 110.888 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 64.44 11.03 6.21 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.917 0.865 . . . . 0.0 110.301 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 m -138.78 141.56 38.79 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.268 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.545 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -86.92 155.4 20.23 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.3 p30 -158.17 129.15 6.42 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.867 0.365 . . . . 0.0 110.738 -173.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -87.1 142.99 27.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.02 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.9 m -122.31 116.98 25.02 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.639 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.5 t -111.42 131.56 55.1 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.742 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.2 tt -121.44 128.89 52.6 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.17 0.509 . . . . 0.0 109.879 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.501 HG12 HD11 ' A' ' 31' ' ' LEU . 33.3 t -121.51 132.33 70.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.656 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -142.5 175.95 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.895 0.379 . . . . 0.0 111.235 -172.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 m120 63.48 46.98 4.03 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.414 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.595 HD22 ' H ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -85.94 150.73 24.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.088 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.455 0 CA-C-O 121.319 0.58 . . . . 0.0 109.465 176.374 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.234 0.238 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.718 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.2 mm -121.56 137.44 55.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.6 t -146.45 144.6 29.79 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.693 0.283 . . . . 0.0 110.741 -179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 64.5 m95 -125.19 156.75 37.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.139 0.495 . . . . 0.0 111.443 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.39 155.1 29.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.505 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.3 m -80.04 157.54 26.72 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -53.51 -25.14 15.38 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.082 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.0 p -78.66 -2.15 37.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.55 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.47 22.06 48.89 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.776 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 42.6 mt-10 -99.55 123.82 46.69 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 25.1 Cg_exo -61.07 136.24 63.98 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.482 2.121 . . . . 0.0 112.097 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.1 mt -101.8 146.29 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.137 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -68.17 105.74 2.19 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 175.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 C--N 1.319 -0.724 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.524 -177.831 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.236 0.342 0 CA-C-O 121.118 0.485 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -110.3 148.78 31.26 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 18.5 ptpt -132.64 141.22 48.54 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.339 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.718 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.27 128.95 6.12 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.781 178.284 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.9 t -109.83 127.04 66.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.908 0.385 . . . . 0.0 110.285 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.605 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.13 130.28 56.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.33 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.0 p -97.37 114.55 26.38 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.288 0.566 . . . . 0.0 111.007 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.545 HG23 ' HB3' ' A' ' 22' ' ' ALA . 17.9 m -119.8 167.15 13.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.083 -176.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.4 m -74.69 146.64 42.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.6 t -58.98 -33.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.45 0.643 . . . . 0.0 109.63 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.64 -33.57 71.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.722 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -63.5 -44.23 94.92 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.362 0.601 . . . . 0.0 109.653 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.466 ' NE1' ' HD3' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -74.29 -34.13 63.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.522 179.501 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -66.99 -25.16 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -95.35 7.38 46.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.703 177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 54.49 37.79 28.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.5 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -63.97 158.46 22.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.137 0.494 . . . . 0.0 111.144 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 35.0 tt0 -109.32 139.53 44.15 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.632 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -123.07 156.83 34.11 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.095 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.425 HG22 ' CD1' ' A' ' 99' ' ' PHE . 98.7 t -125.54 126.04 69.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.489 -175.145 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.838 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.3 p -105.48 142.84 34.54 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -123.26 124.22 42.5 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.194 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.8 t -93.73 125.55 46.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 p -119.66 87.11 2.68 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.564 0.697 . . . . 0.0 111.061 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.463 ' C ' ' H ' ' A' ' 91' ' ' ASP . 52.3 t-80 -98.42 -11.55 22.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.311 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' A' ' 90' ' ' ARG . 0.6 OUTLIER 71.14 -20.75 0.21 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.508 0.723 . . . . 0.0 111.28 -178.669 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.463 ' H ' ' C ' ' A' ' 89' ' ' HIS . 25.0 t70 -72.35 -36.29 68.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.987 0.422 . . . . 0.0 110.431 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.36 150.71 61.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.428 177.082 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 -20.15 15.23 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.93 2.42 . . . . 0.0 112.508 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 57.3 p -145.46 130.52 9.14 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.447 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 15.4 Cg_endo -57.35 140.73 93.93 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.512 2.141 . . . . 0.0 111.561 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' THR . 46.9 mt-30 -86.9 132.91 33.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -107.93 135.83 48.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.575 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.838 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 65.9 mmtt -126.54 135.74 51.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.885 174.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' CD1' HG22 ' A' ' 84' ' ' VAL . 61.5 m-85 -101.46 129.97 47.61 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.734 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 13.9 tt -128.51 138.99 53.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.668 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.5 t -154.85 149.98 26.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.466 ' HD3' ' NE1' ' A' ' 77' ' ' TRP . 22.8 tptm . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.931 -177.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.233 0 CA-C-O 121.605 0.717 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.481 HG23 HD23 ' A' ' 31' ' ' LEU . 77.8 mt -68.93 122.76 20.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.974 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.0 mt -104.44 130.14 52.36 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.497 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 2.4 t -127.93 130.31 48.26 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.197 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -128.44 146.34 50.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.005 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.4 p -112.64 135.01 53.87 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.27 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.96 122.25 31.6 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.004 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.48 141.35 50.58 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.999 2.466 . . . . 0.0 111.967 177.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.543 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.4 Cg_endo -67.87 150.19 78.35 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.605 2.203 . . . . 0.0 111.424 177.538 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.0 t -78.88 131.23 36.35 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.71 -177.03 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.602 ' HB2' ' HE3' ' A' ' 102' ' ' LYS . 61.6 t80 -58.83 -34.01 71.06 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.114 -174.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.65 76.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.337 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.86 -38.08 87.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.055 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 ' HG2' ' A' ' 11' ' ' PRO . 75.1 mt -62.08 -36.82 76.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.355 176.275 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -72.38 -44.31 62.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.568 -178.002 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.4 mp -71.02 -48.28 53.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.586 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.3 m -79.67 -16.18 56.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.871 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 60.7 19.85 9.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.903 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.6 m -139.87 129.94 25.0 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.49 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -90.43 154.83 19.37 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -160.13 130.31 5.42 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.859 0.361 . . . . 0.0 110.733 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -84.22 138.29 33.04 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.992 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.4 m -120.62 127.04 51.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 -178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.517 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 46.5 t -114.53 138.0 51.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.011 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -122.59 123.11 40.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 65' ' ' SER . 46.6 t -120.96 127.05 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.078 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.5 t -143.69 178.8 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.75 0.309 . . . . 0.0 111.235 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 60.02 33.58 21.36 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.314 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.481 HD23 HG23 ' A' ' 4' ' ' ILE . 56.3 mt -57.11 142.28 43.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.728 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.432 178.794 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.9 m120 . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.687 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.1 mm -121.25 136.69 57.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.5 t -138.99 153.19 48.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.517 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 73.9 m95 -134.51 146.99 50.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.383 0.611 . . . . 0.0 111.798 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.47 165.72 34.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.702 -1.136 . . . . 0.0 107.969 176.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.538 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 63.1 p -88.13 173.32 8.9 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.955 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 82' ' ' GLU . 6.0 tp-100 -58.77 -34.97 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.401 0.62 . . . . 0.0 110.062 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.9 m -78.55 -5.7 53.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.806 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 11.71 59.38 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.225 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.538 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 7.1 pt-20 -76.38 131.75 74.22 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -64.43 138.28 59.4 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.282 1.988 . . . . 0.0 112.012 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 49' ' ' LEU . 8.9 mt -120.16 136.07 54.75 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.463 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.92 107.58 7.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.233 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.9 m . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.525 -177.82 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 11.1 m . . . . . 0 N--CA 1.442 -0.867 0 CA-C-O 121.288 0.566 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.443 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -141.49 162.43 35.51 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.065 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -130.27 140.75 50.66 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.687 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.39 127.62 3.87 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.603 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -124.97 133.27 69.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.09 0.472 . . . . 0.0 111.065 -173.512 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.73 134.51 55.04 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.663 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -96.77 119.11 34.64 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.126 0.489 . . . . 0.0 110.327 -174.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' A' ' 22' ' ' ALA . 20.0 m -126.35 166.28 22.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.269 -175.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.9 t -75.02 154.65 37.93 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.2 t -61.2 -33.47 56.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 13.2 mm-40 -62.57 -30.8 71.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.748 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.68 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 6.4 m-20 -59.7 -50.99 71.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.171 0.51 . . . . 0.0 109.652 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -63.11 -37.15 86.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.007 176.862 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 90.6 m-20 -69.49 -18.89 63.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.857 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -94.27 7.06 46.71 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.12 -0.363 . . . . 0.0 111.02 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 57.78 27.36 14.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.874 0.845 . . . . 0.0 109.525 -174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 76' ' ' ASP . 1.3 tppp? -68.5 142.64 55.23 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.188 -1.369 . . . . 0.0 109.963 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 58.1 mt-10 -105.99 143.93 33.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.929 0.395 . . . . 0.0 110.074 -178.431 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.496 ' HA ' ' HA ' ' A' ' 43' ' ' SER . 71.3 m-85 -121.62 154.86 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.839 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 67.1 t -127.68 133.76 66.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.18 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 39.9 t -105.28 132.65 51.21 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.2 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.49 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -114.87 119.7 37.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.331 176.913 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.99 126.91 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.967 -178.282 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.27 98.48 5.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.645 0.736 . . . . 0.0 110.907 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -99.36 -10.51 22.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.161 -177.466 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.44 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 1.6 tmm_? 69.91 7.12 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 122.122 0.963 . . . . 0.0 108.85 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.479 ' HB3' HD11 ' A' ' 4' ' ' ILE . 13.0 t70 -84.23 -33.73 24.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.287 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.73 152.56 65.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.073 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.85 -23.86 16.02 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.061 2.508 . . . . 0.0 112.961 -175.548 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.5 t -131.17 124.45 20.43 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 110.109 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.8 Cg_endo -60.53 142.51 98.15 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 123.498 2.798 . . . . 0.0 112.848 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -81.99 141.41 33.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.908 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.49 ' HG2' HG23 ' A' ' 86' ' ' THR . 30.6 mtpp -112.11 127.03 55.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 0.0 110.549 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.659 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 71.9 mmtt -117.64 140.05 50.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.51 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.428 ' CD1' HG22 ' A' ' 84' ' ' VAL . 72.8 m-85 -101.59 131.73 47.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.3 tt -121.94 138.14 53.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.249 0.547 . . . . 0.0 111.336 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.1 t -159.06 150.69 20.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.096 176.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.602 ' HE3' ' HB2' ' A' ' 13' ' ' PHE . 42.7 tttm . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.684 176.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 120.901 0.382 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.738 HD12 ' HB3' ' A' ' 92' ' ' LEU . 44.9 mt -59.69 121.21 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.993 0.425 . . . . 0.0 111.155 -172.495 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.2 mt -117.53 132.18 56.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.322 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.32 127.3 53.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.815 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -115.96 130.39 56.8 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.554 ' HB ' HD12 ' A' ' 100' ' ' ILE . 11.2 p -115.9 136.46 53.02 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.014 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -116.54 119.21 36.28 Favored Pre-proline 0 N--CA 1.442 -0.844 0 CA-C-O 121.069 0.461 . . . . 0.0 110.042 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 61.1 Cg_endo -71.59 138.98 33.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.554 2.169 . . . . 0.0 111.065 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.429 ' HD2' ' CE2' ' A' ' 77' ' ' TRP . 54.6 Cg_endo -66.97 151.8 81.46 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.593 2.195 . . . . 0.0 111.711 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 16' ' ' ILE . 20.7 t -82.01 137.42 35.1 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.523 ' HA ' HD12 ' A' ' 16' ' ' ILE . 24.4 t80 -57.88 -30.48 65.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.911 -174.812 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -69.09 -46.07 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.565 176.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.55 -39.81 94.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.497 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 13' ' ' PHE . 72.1 mt -59.48 -37.51 70.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.577 176.157 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -68.72 -42.39 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.361 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.2 mt -61.92 -40.15 94.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.811 -177.609 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.443 ' C ' ' H ' ' A' ' 21' ' ' SER . 25.9 t -88.3 -13.71 40.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.051 -179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' SER . 86.0 tttt 70.88 -8.47 0.95 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.711 0.767 . . . . 0.0 110.618 -174.102 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 19' ' ' SER . 20.0 m -132.41 144.57 50.6 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.268 -178.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.836 ' HB3' ' HB ' ' A' ' 72' ' ' VAL . . . -78.54 175.42 10.37 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.556 ' HA ' HG23 ' A' ' 72' ' ' VAL . 9.9 p30 -160.12 138.05 9.93 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -177.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 31.9 mt -105.97 125.65 51.24 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.01 -176.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.3 m -109.0 127.32 53.98 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.999 0.428 . . . . 0.0 110.54 -177.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.62 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.4 t -118.26 137.13 53.25 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.976 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.15 122.68 32.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.521 ' O ' ' HA ' ' A' ' 65' ' ' SER . 39.2 t -116.08 128.37 73.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.0 p -142.26 177.31 8.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.78 0.324 . . . . 0.0 111.365 -174.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 59.79 38.36 21.53 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.723 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.503 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 69.8 mt -66.49 131.65 46.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.759 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . . . . . . 0 CA--C 1.522 -0.108 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.579 -178.504 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 . . . . . 0 C--O 1.234 0.247 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.614 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -121.05 136.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.1 t -135.48 135.78 40.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.721 0.296 . . . . 0.0 110.271 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.62 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 68.8 m95 -123.24 139.0 54.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.093 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.77 160.14 42.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.741 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.406 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 79.0 p -87.65 161.53 17.63 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.18 176.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.68 -21.42 66.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.059 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.4 p -76.46 -8.46 57.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.811 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.67 22.44 31.16 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.767 -0.73 . . . . 0.0 113.036 176.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -94.47 121.96 62.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.26 135.3 53.42 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.055 1.836 . . . . 0.0 110.516 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.2 mt -108.31 139.79 42.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.367 0.604 . . . . 0.0 111.885 -171.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 3.6 tm-20 -57.22 116.51 3.32 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.386 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 -175.897 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 19.3 m . . . . . 0 N--CA 1.445 -0.723 0 CA-C-O 121.203 0.525 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -143.03 163.92 31.49 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.73 -172.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -127.89 137.99 52.51 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 176.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.614 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -147.02 131.57 4.01 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.702 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.5 p -129.42 137.93 55.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.68 0.276 . . . . 0.0 110.899 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.5 151.48 33.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.5 -177.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 26.3 m -98.0 114.16 26.21 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 122.38 1.086 . . . . 0.0 110.89 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.836 ' HB ' ' HB3' ' A' ' 22' ' ' ALA . 1.7 t -116.93 167.83 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.526 -172.913 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.414 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 19.0 m -100.13 139.97 35.03 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 175.422 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 1.9 p -54.32 -36.61 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-O 121.174 0.512 . . . . 0.0 110.475 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -56.41 -36.55 69.06 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.888 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.565 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 44.3 m-20 -67.26 -48.84 66.52 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.297 0.57 . . . . 0.0 109.938 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.429 ' CE2' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -69.12 -34.56 75.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.264 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 11.5 t-20 -66.14 -22.03 66.36 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.241 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -102.12 10.66 39.29 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.128 177.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 80' ' ' ARG . 13.4 mmt180 58.78 36.71 24.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.306 178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.565 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 61.9 mtpt -74.26 164.25 26.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.991 0.424 . . . . 0.0 110.753 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.82 148.98 42.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.812 -176.076 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 93.7 m-85 -130.64 162.06 30.22 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.222 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.4 t -119.58 129.51 75.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.333 0.587 . . . . 0.0 110.953 -177.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 37.7 t -105.45 140.31 38.74 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 173.108 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 m -126.2 132.79 51.7 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.7 t -112.6 125.69 69.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.092 0.472 . . . . 0.0 111.08 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -107.6 85.76 2.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.616 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.509 ' HB3' HD22 ' A' ' 92' ' ' LEU . 15.0 t-160 -98.8 -16.84 18.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.898 -176.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 70.89 -22.09 0.19 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.102 0.561 . . . . 0.0 111.408 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 89' ' ' HIS . 14.5 t0 -72.26 -37.04 69.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.661 0.743 . . . . 0.0 110.767 -178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 4' ' ' ILE . 1.4 pt? -89.55 147.66 38.42 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.057 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -50.41 -32.91 35.75 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.506 2.137 . . . . 0.0 112.717 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 31.5 m -155.93 154.8 28.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -51.74 139.44 48.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.463 2.108 . . . . 0.0 112.062 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.8 pt20 -94.85 141.89 28.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.453 -177.85 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -107.73 127.59 53.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.138 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -120.23 132.89 55.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.624 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.36 135.72 41.36 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -177.581 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' A' ' 8' ' ' THR . 11.9 tt -126.6 137.45 57.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.8 p -158.61 149.55 20.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.248 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.008 179.463 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 N--CA 1.451 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.466 HG23 HD23 ' A' ' 31' ' ' LEU . 64.9 mt -60.2 123.68 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.688 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 65.7 mt -111.78 131.49 55.29 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.053 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.2 t -117.42 130.58 56.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.588 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.9 135.4 51.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.335 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -113.36 132.78 55.47 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.836 0.35 . . . . 0.0 110.754 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -117.62 124.25 29.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.653 -174.792 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.41 139.45 49.52 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.692 2.262 . . . . 0.0 111.583 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.402 ' HG2' HD11 ' A' ' 16' ' ' ILE . 48.9 Cg_endo -67.18 156.09 67.81 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.993 2.462 . . . . 0.0 112.741 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 16' ' ' ILE . 43.9 t -84.17 137.56 33.45 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.493 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -61.37 -42.42 98.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.469 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.96 -35.58 81.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.984 0.421 . . . . 0.0 110.444 177.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -68.02 -44.25 76.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.326 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 12' ' ' SER . 81.1 mt -59.75 -36.8 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.627 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -72.3 -44.09 63.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.517 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.92 -48.07 75.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.504 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 t -75.15 -21.41 58.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttm 69.4 7.05 6.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.695 0.759 . . . . 0.0 110.309 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.5 t -138.49 142.1 39.39 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.501 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.8 144.38 26.27 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.561 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -130.39 120.36 24.15 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.495 0.664 . . . . 0.0 110.821 -174.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.8 mt -78.1 129.72 35.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.233 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.2 m -116.24 126.17 53.24 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.283 0.563 . . . . 0.0 111.107 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.0 t -127.17 137.0 52.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.149 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.13 137.05 48.86 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.642 177.045 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.626 HG22 ' HB3' ' A' ' 66' ' ' ALA . 11.8 m -117.65 145.3 23.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -142.36 176.43 9.0 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 58.32 48.77 11.99 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.544 0.527 . . . . 0.0 112.068 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.466 HD23 HG23 ' A' ' 4' ' ' ILE . 26.2 mt -82.11 117.03 21.96 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.439 0 CA-C-O 121.399 0.619 . . . . 0.0 110.685 178.145 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 . . . . . 0 CA--C 1.513 -0.473 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.572 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.8 mm -120.5 136.32 57.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 176.29 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.4 m -128.36 126.59 41.0 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.29 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.42 ' HB2' ' OG1' ' A' ' 51' ' ' THR . 67.8 m95 -108.29 137.84 45.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.794 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.03 165.15 34.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.175 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.717 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 24.1 t -79.61 173.27 12.76 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 173.765 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HG23 ' A' ' 84' ' ' VAL . 52.7 tt0 -53.3 -33.67 54.22 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.15 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.4 t -77.52 -7.74 56.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.801 0.334 . . . . 0.0 111.473 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.16 30.44 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.554 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.717 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 9.9 pt-20 -89.2 124.85 63.79 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.34 142.59 94.96 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.712 2.941 . . . . 0.0 114.489 -168.153 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.3 mt -120.47 147.39 45.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.524 175.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 23.1 mm-40 -63.26 106.63 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.319 0.58 . . . . 0.0 111.059 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 18.5 m . . . . . 0 C--N 1.32 -0.708 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.915 -177.31 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 19.3 m . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.835 0.35 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -108.38 155.25 20.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 172.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -130.6 141.37 50.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.108 0.48 . . . . 0.0 110.391 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.572 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.56 123.09 2.79 Favored Glycine 0 N--CA 1.437 -1.288 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.687 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.7 p -125.48 131.37 72.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 120.959 0.409 . . . . 0.0 111.187 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.561 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.33 142.47 46.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.294 -177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 m -98.63 114.03 26.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.501 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.1 m -123.01 165.97 18.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.6 t -78.02 151.81 33.35 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.2 -29.26 46.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 4.3 mm-40 -66.29 -32.71 74.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.413 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -60.39 -45.4 93.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.352 0.596 . . . . 0.0 109.512 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.564 ' CD1' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -72.04 -35.0 69.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.431 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 72.1 m-20 -67.03 -32.77 74.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.373 178.016 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -95.34 11.67 31.84 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? 63.38 38.67 9.94 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.293 0.371 . . . . 0.0 111.986 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -66.03 154.7 38.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -119.92 139.79 51.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.211 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.407 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 78.9 m-85 -128.29 160.64 31.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.609 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.597 HG23 ' HA ' ' A' ' 44' ' ' GLN . 69.5 t -125.23 125.17 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.337 -178.091 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 33.9 t -105.76 132.28 52.07 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.588 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -121.14 134.0 55.22 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -179.292 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.42 125.9 72.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.846 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -123.12 105.64 10.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.193 0.521 . . . . 0.0 110.451 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -101.02 -10.53 20.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.086 -177.353 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.636 ' HD3' ' O ' ' A' ' 90' ' ' ARG . 1.0 OUTLIER 74.1 -0.7 3.28 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 0.0 109.417 -170.973 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 4' ' ' ILE . 24.0 t0 -72.56 -36.62 68.27 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.156 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.19 154.23 58.47 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.372 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -75.16 -21.86 15.14 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.956 2.437 . . . . 0.0 112.779 -177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.1 m -130.1 119.58 18.84 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.106 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.588 ' HB2' HG22 ' A' ' 86' ' ' THR . 50.6 Cg_endo -69.1 143.24 53.32 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.866 2.377 . . . . 0.0 112.725 -177.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -81.2 142.0 33.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.562 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 19.7 ptpt -116.53 143.08 46.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.023 0.439 . . . . 0.0 111.059 179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 48.1 mmtt -122.01 140.83 52.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.608 178.42 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -101.14 146.33 27.61 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 tt -144.9 137.72 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.007 -0.677 . . . . 0.0 112.43 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 p -159.21 142.9 14.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.564 ' HD3' ' CD1' ' A' ' 77' ' ' TRP . 20.8 pttp . . . . . 0 C--O 1.247 0.953 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.444 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 CA--C 1.516 -0.356 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.54 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.3 mt -60.2 121.78 8.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.636 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 30' ' ' ASN . 83.9 mt -104.15 131.02 51.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.115 0.484 . . . . 0.0 111.413 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -121.59 119.45 31.94 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.648 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -116.29 132.27 56.71 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 98' ' ' LYS . 6.6 p -112.45 131.02 55.78 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.234 0.54 . . . . 0.0 110.701 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.9 mm -117.74 123.96 29.26 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.785 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 43.5 Cg_endo -67.33 139.22 49.1 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.203 1.935 . . . . 0.0 110.391 173.728 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.53 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 56.5 Cg_endo -63.77 132.38 34.78 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.053 1.836 . . . . 0.0 110.658 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.5 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 15.4 t -78.5 145.39 34.97 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.852 -176.641 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -59.57 -29.39 67.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.323 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.415 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -65.53 -46.45 79.54 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 174.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 12' ' ' SER . 31.0 m-20 -64.96 -43.6 92.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.607 -179.381 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.5 mt -58.32 -34.65 50.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.581 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -72.14 -42.39 66.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.879 -178.508 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 14' ' ' ALA . 6.9 mp -59.9 -48.84 80.06 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.198 -176.972 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 p -94.6 -10.61 31.46 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 64.54 18.83 11.57 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.3 0.571 . . . . 0.0 110.884 -178.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.6 t -139.02 144.94 39.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.116 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.41 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.16 134.93 33.47 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 39.1 m-80 -137.0 116.82 13.1 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.151 -174.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -73.34 146.01 45.55 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.86 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.5 m -125.27 124.89 42.63 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.683 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.682 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 38.1 t -117.23 134.27 54.99 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.932 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -114.76 123.54 49.5 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.93 128.64 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.821 0.343 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.6 m -144.02 172.29 13.08 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.822 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.46 HD22 HD12 ' A' ' 5' ' ' LEU . 96.5 m-20 60.27 52.19 5.05 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.893 0.746 . . . . 0.0 112.473 171.556 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.54 ' HA ' HG12 ' A' ' 4' ' ' ILE . 30.9 mt -75.87 153.43 36.78 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.16 177.019 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.53 0.205 . . . . 0.0 111.236 -177.511 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.641 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -120.06 135.14 61.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.8 m -124.72 135.01 52.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.828 0.347 . . . . 0.0 110.832 -178.332 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.451 ' CH2' ' HB2' ' A' ' 85' ' ' CYS . 66.2 m95 -125.83 138.01 53.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.104 174.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.74 158.19 41.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.669 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 t -78.54 160.56 27.57 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -55.54 -32.0 62.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.089 0.471 . . . . 0.0 111.086 -179.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.03 -4.77 43.13 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.425 -178.036 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.04 22.97 28.71 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.394 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -92.37 122.12 65.17 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -64.78 144.09 82.43 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.772 2.315 . . . . 0.0 112.786 -177.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 49' ' ' LEU . 5.7 mt -120.4 146.39 46.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.41 0.624 . . . . 0.0 111.783 -178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.33 118.2 11.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.936 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.421 HG21 ' HD1' ' A' ' 41' ' ' TRP . 1.8 m . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.096 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.1 p . . . . . 0 N--CA 1.464 0.258 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.21 143.37 32.72 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.478 0.656 . . . . 0.0 111.974 -163.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 97.8 mttt -130.18 139.09 50.88 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.919 177.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.641 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -119.94 115.52 3.01 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.211 176.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -108.2 120.74 60.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.849 0.357 . . . . 0.0 110.209 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.66 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.97 132.45 56.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.905 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.0 m -98.0 118.95 35.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.191 0.52 . . . . 0.0 110.829 -174.684 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 24' ' ' LEU . 3.4 m -124.43 167.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.152 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.6 t -78.21 149.34 33.69 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -65.48 -27.28 41.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.802 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.12 -35.66 81.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.943 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -65.02 -42.23 94.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -73.8 -36.52 65.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.431 179.214 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 -73.16 -21.15 60.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.913 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -94.96 7.08 47.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.953 0.406 . . . . 0.0 110.209 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.5 ttp180 54.75 39.43 31.36 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.195 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -65.1 164.78 12.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.339 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -108.73 139.2 43.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.616 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.525 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 68.3 m-85 -124.77 148.9 47.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.723 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.1 t -117.6 127.17 75.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.842 -174.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.451 ' HB2' ' CH2' ' A' ' 41' ' ' TRP . 43.8 t -105.44 136.68 44.56 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 97' ' ' LYS . 1.0 OUTLIER -125.93 130.0 50.42 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 178.465 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.75 124.08 54.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.523 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.28 92.48 3.7 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.74 0.781 . . . . 0.0 110.395 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -97.9 -9.22 26.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.294 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.33 17.66 11.07 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.542 -174.207 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -82.99 -27.89 30.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.001 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.52 153.87 77.97 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.177 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.23 -22.78 12.43 Favored 'Trans proline' 0 N--CA 1.465 -0.185 0 C-N-CA 123.076 2.517 . . . . 0.0 112.329 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.403 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 10.6 p -113.82 105.69 54.35 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.432 177.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 30.9 Cg_endo -64.14 141.49 76.47 Favored 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.573 2.182 . . . . 0.0 111.738 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -83.73 128.0 34.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.396 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.537 ' HG2' HG23 ' A' ' 86' ' ' THR . 49.7 mtmt -106.88 139.33 41.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.385 0.612 . . . . 0.0 111.074 178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 42.2 mmtt -118.15 130.71 56.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.686 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -101.45 121.87 42.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.947 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 10' ' ' PRO . 14.0 tt -123.79 139.22 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.114 0.483 . . . . 0.0 110.656 -178.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.1 t -158.1 150.65 22.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.218 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HE2' ' O ' ' A' ' 77' ' ' TRP . 37.2 ttpt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.799 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 . . . . . 0 CA--C 1.515 -0.401 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.55 HG12 ' HA ' ' A' ' 31' ' ' LEU . 76.1 mt -61.37 126.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.571 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.2 mt -104.69 129.74 52.83 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.228 0.537 . . . . 0.0 110.022 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.569 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.2 t -125.24 127.86 47.4 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.72 -179.038 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -123.91 142.06 51.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.43 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.8 p -113.6 135.0 54.39 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.523 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.14 121.9 31.87 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.1 138.89 34.52 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.665 2.243 . . . . 0.0 111.682 177.403 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.5 Cg_endo -68.62 146.88 68.71 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.467 2.111 . . . . 0.0 111.523 178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 m -83.14 142.6 31.11 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.118 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -54.02 -43.77 70.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.658 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.88 -40.64 95.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.945 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.21 -39.38 93.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.09 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HG2' ' A' ' 11' ' ' PRO . 71.6 mt -64.55 -32.89 59.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.602 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -71.59 -37.05 71.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.327 -177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 24.2 mt -67.41 -42.68 82.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.852 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.8 p -85.94 -21.28 27.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.427 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 20' ' ' LYS . 27.9 mmtp 66.97 6.19 4.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.213 -175.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.2 p -138.62 125.62 21.25 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.194 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.51 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -70.34 138.26 51.28 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.6 p30 -117.27 128.4 55.03 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.229 0.538 . . . . 0.0 110.227 -177.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.711 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 77.7 mt -91.22 122.63 34.01 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.635 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 56.5 m -111.19 123.82 50.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.266 0.555 . . . . 0.0 111.081 -176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.479 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.1 t -117.89 137.21 52.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.559 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -121.56 123.58 42.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 87' ' ' VAL . 22.5 t -117.25 120.6 65.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 p -136.08 176.56 8.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.005 -173.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 12.7 m120 56.98 50.6 11.89 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.763 0.664 . . . . 0.0 111.769 175.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HA ' HG12 ' A' ' 4' ' ' ILE . 39.0 mt -74.5 128.91 36.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.683 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.292 -176.575 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.3 t30 . . . . . 0 N--CA 1.448 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.489 HG22 HG21 ' A' ' 51' ' ' THR . 3.0 mp -120.76 135.34 61.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 174.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.3 m -129.6 122.86 29.94 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.658 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.612 ' HD1' HG23 ' A' ' 51' ' ' THR . 79.7 m95 -106.11 136.94 44.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.165 0.507 . . . . 0.0 110.829 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.56 141.0 18.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.87 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 44.6 t -70.57 151.3 45.18 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 175.636 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -64.57 -21.25 66.65 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.693 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.413 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 3.9 m -75.42 -4.72 41.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.108 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.68 23.16 26.66 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.852 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.548 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 23.7 mt-10 -95.46 120.77 63.2 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 11.8 Cg_exo -70.63 141.99 43.0 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.238 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.5 mt -126.53 141.5 51.85 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.103 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -80.67 107.25 13.32 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.356 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.612 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.6 m . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.489 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -115.15 160.56 19.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.936 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -130.46 140.93 50.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -141.01 124.11 2.48 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.711 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.4 p -119.0 135.98 57.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-O 121.011 0.434 . . . . 0.0 111.354 -174.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.491 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.9 147.87 40.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.708 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.8 m -99.44 114.34 27.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.839 0.352 . . . . 0.0 110.195 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.51 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.8 m -122.34 166.88 16.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.17 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.5 m -86.02 145.52 27.05 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 74' ' ' VAL . 2.4 t -60.06 -33.57 53.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 CA-C-O 121.676 0.751 . . . . 0.0 109.517 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.8 mp0 -57.1 -37.44 71.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.893 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -62.34 -42.37 99.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.724 0.773 . . . . 0.0 109.015 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.541 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -69.87 -41.01 75.37 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.347 178.849 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -71.96 -21.79 61.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.481 -178.432 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -97.53 9.12 43.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.58 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 58.51 36.86 25.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.643 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 81' ' ' LYS . 51.2 mtpt -71.34 162.8 28.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.81 0.338 . . . . 0.0 110.8 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -106.98 137.8 44.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.188 0.518 . . . . 0.0 110.575 -177.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.541 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 76.1 m-85 -125.31 146.34 49.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.692 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 99.5 t -121.17 129.02 76.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.808 -176.272 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.757 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.2 p -107.11 123.28 48.0 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -112.17 131.1 55.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.107 -178.812 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 28' ' ' VAL . 40.2 t -105.46 127.33 60.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.989 -176.173 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.8 p -120.46 90.6 3.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.515 0.674 . . . . 0.0 110.669 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.523 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 11.3 t-160 -99.44 -10.17 22.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.658 -175.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.523 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 8.2 tpt180 74.04 0.68 3.68 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.158 0.98 . . . . 0.0 109.853 -174.034 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.466 ' CB ' HD11 ' A' ' 4' ' ' ILE . 12.2 t70 -73.76 -36.4 65.09 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.286 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.34 154.84 80.71 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.701 -177.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.17 -31.37 12.07 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.929 2.419 . . . . 0.0 112.434 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 21.0 m -112.63 109.17 53.46 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.642 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 86' ' ' THR . 17.8 Cg_endo -59.68 140.27 92.75 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.569 2.179 . . . . 0.0 111.789 -178.468 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.2 143.49 31.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.452 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -128.59 144.07 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.439 -177.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.757 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 69.6 mmtt -126.28 146.59 49.95 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.197 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.26 129.69 55.5 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 8' ' ' THR . 15.0 tt -131.31 138.73 52.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.84 0.352 . . . . 0.0 110.57 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.3 m -157.14 150.41 23.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.776 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 22.2 tptm . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.661 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 120.661 0.267 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.645 HG23 HD23 ' A' ' 31' ' ' LEU . 93.8 mt -84.3 125.63 40.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 174.04 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' ' 30' ' ' ASN . 1.5 mm? -100.81 130.52 46.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.183 0.516 . . . . 0.0 110.245 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.551 HG21 HG11 ' A' ' 87' ' ' VAL . 23.4 p -117.88 135.45 54.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.025 -178.145 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -133.43 143.54 48.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.519 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 p -113.84 136.97 52.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.199 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 38.6 mm -117.27 125.03 28.5 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.885 0.374 . . . . 0.0 110.699 -176.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.43 140.15 21.4 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.075 2.517 . . . . 0.0 112.212 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.78 152.11 74.13 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.949 2.432 . . . . 0.0 112.249 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.451 ' HB3' ' OD1' ' A' ' 15' ' ' ASP . 47.9 t -90.98 151.68 20.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.308 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HE1' ' HE3' ' A' ' 102' ' ' LYS . 58.2 m-85 -60.93 -31.86 71.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.242 -174.442 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.5 75.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.628 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.3 m-20 -74.48 -24.96 59.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.363 0.602 . . . . 0.0 110.72 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 22' ' ' ALA . 69.8 mt -74.48 -25.27 19.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.651 0.739 . . . . 0.0 109.384 172.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -73.7 -47.62 38.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.355 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.766 HD13 ' H ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -77.94 -36.36 49.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.362 0.601 . . . . 0.0 111.547 -169.971 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.766 ' H ' HD13 ' A' ' 18' ' ' LEU . 24.1 t -89.85 -8.45 51.95 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.988 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.3 mttm 59.07 16.32 4.67 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.015 -178.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.1 m -139.77 152.81 46.89 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.516 ' O ' HG22 ' A' ' 72' ' ' VAL . . . -94.09 122.61 36.78 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.473 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 55.1 m-80 -106.28 128.35 53.91 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.429 0.633 . . . . 0.0 111.071 -174.285 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.576 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 85.9 mt -84.29 138.01 33.15 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.886 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 89.7 m -124.92 117.63 24.49 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.38 0.61 . . . . 0.0 110.497 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.574 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.6 t -109.93 131.99 54.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.417 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.1 tt -126.24 130.67 51.37 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.171 0.51 . . . . 0.0 110.54 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG12 HD21 ' A' ' 31' ' ' LEU . 44.9 t -122.36 125.28 72.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.754 -178.691 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' SER . . . . . 0.55 ' HB3' ' OG ' ' A' ' 65' ' ' SER . 14.5 p -138.91 176.26 8.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.226 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ASN . . . . . 0.483 ' HB2' HD23 ' A' ' 5' ' ' LEU . 3.8 m-20 59.05 46.7 13.0 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.644 0.59 . . . . 0.0 111.041 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.668 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 15.8 mt -79.74 160.23 26.3 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.99 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.446 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 176.059 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 65.1 t30 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 20.2 mm -119.74 135.82 58.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -132.06 135.16 46.28 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.732 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.574 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 56.9 m95 -116.74 138.6 51.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.024 0.44 . . . . 0.0 110.818 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -150.23 162.29 40.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.322 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 36.6 t -74.82 168.07 20.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -63.67 -24.35 67.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.928 0.394 . . . . 0.0 111.391 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.7 m -83.55 3.38 32.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.408 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.48 22.13 54.7 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.861 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 36.3 mt-10 -87.46 121.78 70.98 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -178.334 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 48.3 Cg_exo -56.38 142.67 88.42 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 123.326 2.684 . . . . 0.0 113.28 -175.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 49' ' ' LEU . 4.5 mt -123.17 146.8 47.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.713 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.63 108.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.96 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.449 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 8.5 m . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.145 -177.145 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.55 ' OG ' ' HB3' ' A' ' 29' ' ' SER . 8.2 m . . . . . 0 N--CA 1.45 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 112.073 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.539 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.12 150.03 28.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.369 175.401 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 20.4 ttmm -131.58 139.31 49.16 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -132.92 128.76 5.23 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.61 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.576 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.6 t -114.43 125.01 71.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.728 0.299 . . . . 0.0 111.24 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.473 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -118.44 146.76 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.068 175.816 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.4 m -100.33 122.29 42.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.825 0.345 . . . . 0.0 110.662 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 22' ' ' ALA . 1.5 m -122.42 167.24 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.36 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -71.76 143.01 49.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.85 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -61.8 -35.25 66.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.818 0.818 . . . . 0.0 108.85 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.89 -32.35 74.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.787 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.02 -47.62 83.93 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.584 ' HH2' HG12 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -67.87 -42.83 80.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.754 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.64 -28.0 68.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.534 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -89.43 7.39 36.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.602 0.239 . . . . 0.0 110.739 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 64.81 37.32 7.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.007 176.53 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 81' ' ' LYS . 26.7 mmmt -72.44 160.01 33.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.185 178.434 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -124.06 138.82 54.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.806 -177.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 90.9 m-85 -122.73 160.98 24.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.705 -178.282 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.1 t -124.62 128.89 73.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.056 0.455 . . . . 0.0 110.854 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.744 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 26.4 p -106.5 142.98 35.27 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.02 176.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -122.48 121.59 36.93 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.255 0.55 . . . . 0.0 110.999 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.551 HG11 HG21 ' A' ' 6' ' ' THR . 0.5 OUTLIER -104.27 134.96 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.353 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.8 92.92 3.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.307 0.575 . . . . 0.0 110.425 -173.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.668 ' CE1' ' HB3' ' A' ' 31' ' ' LEU . 3.2 t-160 -99.03 -10.98 21.92 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.25 9.78 2.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.773 0.797 . . . . 0.0 110.092 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.499 ' HB3' HD11 ' A' ' 4' ' ' ILE . 43.9 t0 -101.7 -23.67 14.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.959 -173.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.498 HD22 ' HG3' ' A' ' 96' ' ' GLN . 0.4 OUTLIER -108.55 160.33 27.58 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.058 179.718 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.13 -32.51 94.72 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.115 1.877 . . . . 0.0 112.826 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.413 ' O ' HD13 ' A' ' 92' ' ' LEU . 23.1 t -153.68 141.7 13.91 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -177.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.92 140.8 47.84 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.011 2.474 . . . . 0.0 111.571 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.498 ' HG3' HD22 ' A' ' 92' ' ' LEU . 41.8 mt-30 -89.68 130.02 36.02 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.805 -175.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 52.3 mtmt -101.9 126.82 48.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.374 176.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.744 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -123.3 141.94 51.46 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.94 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -99.7 142.79 30.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.899 -176.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.584 HG12 ' HH2' ' A' ' 77' ' ' TRP . 13.6 tt -134.87 137.56 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.152 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.9 t -157.97 149.84 21.84 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.108 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.562 ' HE3' ' HE1' ' A' ' 13' ' ' PHE . 76.4 tttt . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.495 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 121.598 0.713 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.636 HG23 HD23 ' A' ' 31' ' ' LEU . 76.2 mt -64.64 122.93 16.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.051 176.358 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.1 mt -109.48 130.58 55.49 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.93 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.9 t -111.4 133.48 53.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.325 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -125.21 142.27 51.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.725 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.2 p -115.6 136.81 52.7 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.909 0.385 . . . . 0.0 111.129 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.491 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -118.71 125.98 27.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.022 178.354 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -78.94 139.57 15.46 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.786 2.324 . . . . 0.0 111.622 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -69.96 149.77 66.05 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.573 2.182 . . . . 0.0 111.81 178.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.467 ' O ' HG13 ' A' ' 16' ' ' ILE . 21.8 m -88.26 137.3 32.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.403 -177.326 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.55 ' HA ' HD12 ' A' ' 16' ' ' ILE . 75.6 t80 -54.18 -37.39 64.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.772 -1.103 . . . . 0.0 112.996 -169.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.38 -46.56 69.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.82 0.343 . . . . 0.0 110.653 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.95 -38.93 93.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.664 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 13' ' ' PHE . 89.1 mt -58.26 -39.85 75.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.798 176.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -69.41 -44.6 71.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.805 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 18' ' ' LEU . 4.4 mm? -69.87 -44.6 69.47 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.331 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -70.8 -7.66 46.87 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.884 -178.277 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 72.48 -18.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.549 0.739 . . . . 0.0 111.517 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 19' ' ' SER . 57.4 m -138.72 162.35 34.9 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 176.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.563 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -99.19 159.32 15.07 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.518 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -128.08 134.54 49.17 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.237 0.542 . . . . 0.0 110.384 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 70.8 mt -88.35 126.04 35.0 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.491 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 62.7 m -111.0 112.32 24.06 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.413 0.625 . . . . 0.0 111.065 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.512 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 37.7 t -111.77 129.12 56.23 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.322 176.663 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -124.1 123.35 40.13 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 87' ' ' VAL . 12.0 t -118.15 119.95 62.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.426 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.2 t -135.04 178.2 7.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.33 -174.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.8 41.86 20.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.345 0.593 . . . . 0.0 110.764 -176.905 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.636 HD23 HG23 ' A' ' 4' ' ' ILE . 43.4 mt -70.38 126.14 28.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.745 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.352 -175.716 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.1 t30 . . . . . 0 N--CA 1.451 -0.425 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.577 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.0 mm -121.08 140.29 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.242 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -142.19 135.68 29.18 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 122.019 -0.426 . . . . 0.0 111.456 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.521 ' HD1' HG21 ' A' ' 51' ' ' THR . 67.6 m95 -119.21 149.88 41.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.888 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.45 144.67 18.46 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.192 175.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -65.09 163.17 15.4 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.351 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 31.1 tt0 -53.43 -31.6 46.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.228 0.537 . . . . 0.0 110.941 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.8 t -72.87 -0.68 14.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.075 -178.733 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.51 17.77 67.82 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.57 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.477 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 52.5 mt-10 -93.99 127.86 43.52 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -176.115 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.7 Cg_exo -57.97 136.32 74.36 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 123.036 2.491 . . . . 0.0 112.911 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.688 HD12 ' HB1' ' A' ' 70' ' ' ALA . 0.3 OUTLIER -97.69 146.84 24.94 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.915 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 6.8 tp10 -67.31 104.67 1.55 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.292 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.521 HG21 ' HD1' ' A' ' 41' ' ' TRP . 1.7 m . . . . . 0 C--N 1.311 -1.072 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.287 -177.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.8 p . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.84 148.2 28.82 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.92 171.085 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HE2' HG23 ' A' ' 25' ' ' THR . 63.5 tttm -132.31 139.23 48.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -175.368 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.577 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.97 133.98 7.81 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.782 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 45.7 t -114.49 124.21 70.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.688 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -114.85 155.98 25.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.4 179.112 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 m -108.41 121.35 44.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.673 0.273 . . . . 0.0 110.998 -172.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.563 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 4.2 m -128.34 153.35 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.211 0.529 . . . . 0.0 110.115 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 m -77.5 145.93 36.71 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.994 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.414 HG22 HG22 ' A' ' 16' ' ' ILE . 25.9 t -58.03 -33.57 46.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.463 0.649 . . . . 0.0 109.663 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -57.63 -42.34 83.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.222 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -67.58 -41.35 84.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.684 ' CD1' ' HG2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -68.98 -35.14 76.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.185 179.468 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -69.62 -26.28 64.36 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.052 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -91.51 7.1 42.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.028 0.442 . . . . 0.0 110.004 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 60.02 39.13 20.27 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.582 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 81' ' ' LYS . 3.2 mmpt? -56.67 147.45 22.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.962 174.344 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.455 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -115.0 139.33 49.94 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.882 178.042 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -125.5 158.09 35.36 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.524 -176.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 76.6 t -123.06 125.52 72.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.575 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.8 p -105.76 135.44 47.17 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.478 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.2 OUTLIER -125.31 136.29 53.33 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 28' ' ' VAL . 28.8 t -110.57 127.72 67.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.829 0.347 . . . . 0.0 111.154 -175.704 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 p -114.85 90.17 3.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.418 0.628 . . . . 0.0 111.409 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 19.9 t-80 -98.66 -15.41 19.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.667 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 90' ' ' ARG . 0.1 OUTLIER 64.12 24.02 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.486 -178.548 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -98.91 -36.51 9.74 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.51 0.671 . . . . 0.0 109.462 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -100.08 148.03 34.29 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.808 172.41 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.53 -22.48 38.45 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.269 2.646 . . . . 0.0 112.884 -172.109 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' HD13 ' A' ' 92' ' ' LEU . 14.3 m -132.88 130.07 21.4 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 24.5 Cg_exo -62.56 141.0 84.59 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.464 2.109 . . . . 0.0 112.139 -178.645 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.4 pt20 -87.99 142.01 28.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.395 -178.58 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 20.1 ptmt -127.17 148.47 50.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.225 0.536 . . . . 0.0 111.209 -175.74 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 61.6 mmtt -134.15 145.6 49.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.611 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.48 ' CD1' HG22 ' A' ' 84' ' ' VAL . 34.3 m-85 -105.7 142.69 35.01 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.073 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 9.7 tt -142.38 138.12 29.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.766 0.317 . . . . 0.0 111.191 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 p -158.34 148.66 20.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.775 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.684 ' HG2' ' CD1' ' A' ' 77' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.822 -0.609 . . . . 0.0 110.022 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 CA--C 1.517 -0.299 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.611 HG12 ' HA ' ' A' ' 31' ' ' LEU . 64.5 mt -59.61 121.65 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.51 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -103.98 131.05 51.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.515 -176.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.475 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 11.6 p -117.5 122.17 42.97 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.427 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -133.92 145.41 49.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.034 0.445 . . . . 0.0 110.406 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.8 p -115.41 135.91 53.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.317 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.15 121.82 31.96 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.543 ' HA ' HD11 ' A' ' 100' ' ' ILE . 59.4 Cg_endo -70.44 140.01 39.15 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.751 2.301 . . . . 0.0 111.654 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HG2' HD11 ' A' ' 16' ' ' ILE . 66.1 Cg_endo -68.88 144.96 60.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.26 1.973 . . . . 0.0 110.806 176.992 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -79.2 138.15 37.72 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -54.05 -42.59 69.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.72 0.295 . . . . 0.0 111.287 -170.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.4 -38.25 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.339 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -66.27 -35.9 81.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.059 0.457 . . . . 0.0 110.349 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.479 HD11 ' HG2' ' A' ' 11' ' ' PRO . 53.7 mt -67.36 -32.04 55.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.01 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -66.49 -36.94 83.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.652 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.0 mt -76.82 -48.01 19.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.006 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.7 m -80.53 -10.35 59.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.408 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 63.2 mmtt 71.05 -57.09 0.61 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.557 0.743 . . . . 0.0 111.739 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 20.0 m -95.08 127.17 40.93 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 176.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.541 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -60.97 145.53 50.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.777 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -120.62 124.53 45.48 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.302 0.572 . . . . 0.0 110.558 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 83.5 mt -83.36 130.52 35.06 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.807 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 m -115.26 122.76 46.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.183 0.516 . . . . 0.0 111.139 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.409 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.9 t -111.27 138.47 47.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.723 -178.681 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -126.19 122.45 35.67 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 t -127.86 120.83 54.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 t -137.43 177.08 8.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.5 -173.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.6 35.8 24.74 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.116 0.566 . . . . 0.0 112.048 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.611 ' HA ' HG12 ' A' ' 4' ' ' ILE . 48.9 mt -60.07 124.95 21.82 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.2 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -170.316 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.3 mm -120.43 135.82 59.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 m -139.27 125.84 20.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.077 0.465 . . . . 0.0 111.531 -176.493 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.546 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 85.8 m95 -106.81 148.2 28.79 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.122 174.923 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.0 156.13 36.83 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 22.8 m -87.84 156.8 19.21 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -60.24 -19.98 56.9 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -72.76 -7.35 50.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.211 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.8 18.24 41.44 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.041 176.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 13.2 pt-20 -101.81 133.9 20.48 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 120.507 0.194 . . . . 0.0 110.745 -177.222 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 12.1 Cg_exo -69.78 136.79 33.81 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.676 2.251 . . . . 0.0 112.416 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.0 mt -106.08 142.02 36.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.62 177.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -64.57 106.72 1.21 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.938 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 12.2 m . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.804 178.83 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.5 p . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.659 0.742 . . . . 0.0 112.885 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.71 148.34 30.61 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.112 167.298 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -131.48 140.64 49.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.69 127.49 4.11 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.608 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.581 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 43.3 t -115.08 128.29 72.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.759 0.314 . . . . 0.0 110.596 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -116.53 148.64 40.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.69 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 m -99.93 124.1 44.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.266 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.541 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.6 m -119.73 166.96 13.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.471 ' HB3' ' OD2' ' A' ' 76' ' ' ASP . 23.2 t -86.68 154.29 21.1 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.193 -178.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.37 -39.66 85.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.076 0.465 . . . . 0.0 110.67 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -58.36 -36.24 73.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.789 -178.159 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 73' ' ' SER . 13.3 m-20 -63.94 -45.02 91.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.335 0.588 . . . . 0.0 110.094 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.457 ' HE1' ' HD2' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.5 -35.07 68.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.196 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -65.76 -30.22 70.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.235 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ASN . . . . . 0.401 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 95.3 m-20 -90.85 7.27 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.096 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 57.89 36.77 26.6 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.387 0.43 . . . . 0.0 110.912 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 31.6 mmmt -68.93 163.31 24.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.336 -177.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 51.3 mt-10 -114.69 139.75 49.41 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.507 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 99' ' ' PHE . 75.1 m-85 -121.14 157.29 30.47 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.792 177.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 93.5 t -120.75 129.0 76.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 0.0 110.967 -176.059 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.546 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 34.9 t -106.18 127.62 53.34 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.458 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.12 126.16 52.38 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.1 t -105.9 125.67 61.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.143 0.497 . . . . 0.0 111.1 -177.147 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.1 p -120.56 103.9 9.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.731 ' ND1' ' HB2' ' A' ' 91' ' ' ASP . 39.6 t-80 -98.39 -20.37 17.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.048 -176.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.509 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 18.9 ttt180 74.04 8.13 4.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.008 0.908 . . . . 0.0 108.786 -169.801 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.731 ' HB2' ' ND1' ' A' ' 89' ' ' HIS . 11.2 t0 -93.58 -36.41 12.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.773 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -119.32 151.96 51.88 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.319 178.501 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.58 -31.33 11.05 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 123.017 2.478 . . . . 0.0 112.801 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.3 m -116.77 111.54 41.17 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.168 -176.802 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.91 141.25 83.63 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.257 1.971 . . . . 0.0 111.939 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -86.43 127.4 34.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -112.76 128.31 56.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.305 178.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 64.5 mmtt -122.77 149.32 44.27 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.023 -174.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PHE . . . . . 0.419 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.4 m-85 -105.73 146.79 29.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.966 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.8 tt -136.34 138.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.265 175.324 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.428 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 10.7 t -158.85 149.92 20.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.523 177.726 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.821 ' HE2' ' HA ' ' A' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.558 -0.735 . . . . 0.0 110.321 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 . . . . . 0 C--O 1.234 0.25 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.592 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.1 mt -70.7 123.12 24.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.264 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.1 mt -104.95 131.03 52.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.009 0.433 . . . . 0.0 110.345 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.415 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 13.9 p -109.42 123.48 49.42 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.843 -179.067 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -119.32 131.39 55.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 3.2 p -119.51 131.57 55.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.369 176.273 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.88 124.48 28.75 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.975 0.417 . . . . 0.0 110.495 -178.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.41 140.73 24.69 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.886 2.391 . . . . 0.0 111.507 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.551 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 51.8 Cg_endo -64.85 147.41 89.44 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.578 2.185 . . . . 0.0 111.845 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.403 ' O ' HG13 ' A' ' 16' ' ' ILE . 10.7 p -89.56 146.44 24.58 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.136 -177.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' PHE . . . . . 0.83 ' HE1' ' HE2' ' A' ' 102' ' ' LYS . 47.9 m-85 -59.76 -31.39 69.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.446 -174.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.15 76.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.563 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.02 -35.07 66.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.502 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 12' ' ' SER . 83.1 mt -63.46 -32.02 55.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.461 176.11 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -62.99 -43.93 97.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.405 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.98 -47.87 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.422 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.6 m -70.69 -24.24 62.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.972 -177.188 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt 70.94 -6.07 1.36 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.496 0.718 . . . . 0.0 111.368 -177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 71.3 p -137.9 161.99 35.2 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.73 32.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -125.88 130.26 50.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.986 0.422 . . . . 0.0 110.057 -177.562 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 88.6 mt -86.29 128.91 34.99 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.45 -176.574 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' THR . . . . . 0.409 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 18.2 m -109.05 114.4 28.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.504 -178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.597 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 25.3 t -114.05 134.82 54.61 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.117 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -135.97 129.11 31.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.142 0.496 . . . . 0.0 110.109 175.977 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.466 HG11 HG11 ' A' ' 87' ' ' VAL . 15.4 t -123.35 132.87 70.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -143.3 171.84 13.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.156 0.503 . . . . 0.0 111.557 -173.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 64.51 48.95 2.53 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.173 169.821 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.592 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -72.79 157.17 38.0 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.098 -1.41 . . . . 0.0 109.122 178.754 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 120.881 0.372 . . . . 0.0 110.926 -179.81 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.3 t30 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.729 HG21 ' HA3' ' A' ' 68' ' ' GLY . 17.5 mm -121.14 136.05 59.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.842 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 t -145.67 128.58 16.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.896 0.379 . . . . 0.0 110.863 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.597 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 55.2 m95 -108.7 149.03 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.474 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.55 163.81 38.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.622 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 t -84.68 168.69 15.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' GLU . 56.4 tt0 -57.37 -29.18 63.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.086 0.47 . . . . 0.0 110.85 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -73.66 -4.3 33.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.526 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.1 20.79 54.52 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.812 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.8 mt-10 -99.64 123.6 47.29 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 32.2 Cg_exo -58.66 137.55 80.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.154 2.569 . . . . 0.0 113.217 -173.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -106.34 148.35 28.14 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.664 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.514 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 39.4 mm-40 -62.71 106.59 0.82 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.808 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' THR . . . . . 0.529 HG23 ' HD1' ' A' ' 41' ' ' TRP . 3.1 m . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.874 -177.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.312 0 CA-C-O 121.669 0.747 . . . . 0.0 112.859 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.432 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.54 158.51 17.94 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.287 175.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -134.23 140.43 46.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.747 0.308 . . . . 0.0 110.462 -176.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.729 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -139.43 138.69 9.45 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -123.2 129.0 75.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.802 0.334 . . . . 0.0 110.78 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.61 150.49 37.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.406 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.4 m -102.63 119.85 39.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.8 m -127.19 166.4 23.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.977 0.418 . . . . 0.0 110.779 -176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.566 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.8 m -85.16 137.62 32.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.271 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -65.67 -24.98 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.436 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.2 -33.95 76.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.034 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ASP . . . . . 0.566 ' OD1' ' HB2' ' A' ' 73' ' ' SER . 3.5 m-20 -66.11 -41.32 90.71 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.551 ' CZ2' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -65.86 -41.33 91.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.072 177.455 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -67.28 -30.07 69.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.995 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -91.38 8.01 38.28 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.214 -0.195 . . . . 0.0 111.061 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.97 37.26 21.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.467 -178.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -67.2 161.83 23.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.05 0.453 . . . . 0.0 110.146 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 45.8 mt-10 -112.65 140.53 47.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.42 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.9 m-85 -121.32 149.69 42.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.482 176.081 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 90.2 t -123.01 120.33 60.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.083 -173.591 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.7 p -105.67 135.32 47.3 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 95' ' ' PRO . 1.2 m -122.38 132.94 54.62 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.775 0.322 . . . . 0.0 110.156 -177.366 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.466 HG11 HG11 ' A' ' 28' ' ' VAL . 44.3 t -109.1 126.99 66.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.766 -178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -117.8 88.5 2.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.59 0.709 . . . . 0.0 111.58 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.526 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 8.1 t-160 -98.82 -6.89 28.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.514 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 0.1 OUTLIER 52.29 24.09 2.7 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.901 -175.169 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -94.05 -28.51 15.69 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.562 -179.22 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -118.23 156.07 51.01 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.049 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.52 -21.86 39.4 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.056 2.504 . . . . 0.0 113.106 -175.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.498 ' O ' HD13 ' A' ' 92' ' ' LEU . 37.5 p -134.63 125.0 17.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.499 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HB2' HG22 ' A' ' 86' ' ' THR . 18.0 Cg_endo -61.35 141.38 92.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.585 2.19 . . . . 0.0 111.412 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 86' ' ' THR . 33.2 mt-30 -80.58 126.73 31.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.964 0.411 . . . . 0.0 111.148 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -107.36 126.71 52.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.368 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.663 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 16.7 mmtt -115.27 133.78 55.73 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.967 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.21 122.75 44.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.799 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 12.5 tt -122.17 139.89 47.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.159 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -157.28 150.01 23.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.047 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.83 ' HE2' ' HE1' ' A' ' 13' ' ' PHE . 47.7 tttm . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.813 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.6 HG23 HD23 ' A' ' 31' ' ' LEU . 73.5 mt -60.4 121.49 8.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.228 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.31 138.32 43.72 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.257 -176.133 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 28' ' ' VAL . 2.2 p -115.05 120.07 38.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.858 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -119.36 132.01 55.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 p -115.63 132.48 56.62 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.258 176.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.96 125.92 27.64 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.81 0.338 . . . . 0.0 110.427 -177.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PRO . . . . . 0.47 ' HA ' HD11 ' A' ' 100' ' ' ILE . 55.9 Cg_endo -70.75 139.59 37.1 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.612 2.208 . . . . 0.0 111.444 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.499 ' HG2' HD11 ' A' ' 16' ' ' ILE . 55.7 Cg_endo -68.81 154.96 70.18 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.736 2.29 . . . . 0.0 112.447 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.438 ' O ' HG13 ' A' ' 16' ' ' ILE . 11.9 p -84.82 126.09 33.15 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 -177.599 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -61.4 -30.83 70.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.554 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -62.18 -40.28 95.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 177.134 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.04 -43.14 58.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.903 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.499 HD11 ' HG2' ' A' ' 11' ' ' PRO . 76.5 mt -57.69 -32.69 43.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.469 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.08 -39.0 93.41 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.43 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 41.1 mt -72.6 -48.14 42.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.557 -173.27 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.8 p -86.46 -18.16 32.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.865 0.364 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm 68.87 16.12 8.87 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.734 0.813 . . . . 0.0 110.117 -174.738 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -135.35 128.88 32.53 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.314 -176.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.14 136.61 32.86 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.613 176.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 48.8 m-80 -122.93 125.9 46.21 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.147 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 70.9 mt -83.46 131.08 35.04 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.003 -178.068 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.2 m -119.07 121.19 39.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.286 0.565 . . . . 0.0 110.949 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' CYS . . . . . 0.584 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.4 t -126.88 137.97 53.24 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.171 178.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 3.9 tt -133.5 132.9 41.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.009 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 87' ' ' VAL . 43.6 t -115.12 118.52 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.864 -178.101 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.9 p -121.2 178.57 4.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.869 -169.287 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 59.17 35.88 23.76 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.464 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.6 HD23 HG23 ' A' ' 4' ' ' ILE . 9.7 mt -71.79 123.64 23.08 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.307 0 CA-C-O 121.143 0.496 . . . . 0.0 110.922 -178.96 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t30 . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ILE . . . . . 0.509 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.2 mm -120.08 134.41 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 m -129.32 133.84 47.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.041 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' TRP . . . . . 0.584 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 79.6 m95 -111.77 146.59 37.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.23 174.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.07 164.39 38.1 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.927 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.4 t -73.8 167.17 21.96 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 84' ' ' VAL . 35.9 tt0 -59.78 -31.22 69.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.008 0.432 . . . . 0.0 110.841 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.427 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 18.4 m -75.11 -6.81 51.52 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.35 19.69 37.77 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.295 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 6.6 mm-40 -81.77 122.42 80.25 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 23.3 Cg_exo -62.38 135.8 55.85 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.546 2.164 . . . . 0.0 113.352 -172.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 49' ' ' LEU . 7.6 mt -105.91 148.36 27.71 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.217 177.353 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.65 106.33 2.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.419 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.824 -178.759 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 5.5 m . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.071 0.463 . . . . 0.0 111.622 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . 0.427 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.49 160.96 15.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.785 177.124 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.3 ttmt -130.59 139.11 50.41 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLY . . . . . 0.509 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -126.36 119.65 3.47 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.471 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 46.6 t -108.48 123.98 64.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.808 0.337 . . . . 0.0 110.818 -177.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.98 137.15 52.37 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.081 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.7 m -98.99 116.09 30.44 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.238 0.542 . . . . 0.0 110.144 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' VAL . . . . . 0.416 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.3 m -120.34 166.82 14.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.692 -177.091 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 m -75.95 134.19 40.27 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.6 p -53.02 -34.07 20.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.762 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -56.83 -40.81 76.71 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.456 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -67.24 -44.67 78.84 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.476 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -63.5 -42.01 98.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.824 176.643 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ASN . . . . . 0.6 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 7.5 t30 -73.11 -11.71 60.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.988 -176.314 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -107.18 12.61 28.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 65.74 37.85 5.53 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.783 176.753 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -76.84 152.72 35.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.115 0.483 . . . . 0.0 111.545 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 42.6 mt-10 -109.35 138.82 45.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.252 177.15 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -125.37 151.92 45.47 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.02 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 88.2 t -116.54 129.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.38 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' CYS . . . . . 0.675 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 43.3 t -105.89 131.87 52.69 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' THR . . . . . 0.549 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -125.99 137.34 53.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -128.29 133.46 66.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.197 0.522 . . . . 0.0 112.139 -173.169 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -114.93 100.44 8.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.681 -177.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' HIS . . . . . 0.442 ' C ' ' H ' ' A' ' 91' ' ' ASP . 18.5 t60 -99.79 -11.03 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.696 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 50.0 ttt180 74.06 -24.05 0.21 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.045 0.538 . . . . 0.0 111.116 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 89' ' ' HIS . 39.0 t70 -71.97 -31.88 66.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.158 0.504 . . . . 0.0 110.46 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.78 152.22 42.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.747 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.29 -21.87 10.09 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.192 2.595 . . . . 0.0 113.249 -176.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 57.4 p -125.76 114.95 24.71 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.453 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' PRO . . . . . 0.549 ' HB2' HG22 ' A' ' 86' ' ' THR . 16.3 Cg_endo -58.25 141.87 97.02 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 111.228 176.92 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLN . . . . . 0.511 ' O ' ' HA ' ' A' ' 86' ' ' THR . 44.4 mt-30 -91.19 128.47 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.761 -173.24 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.675 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.6 ptmt -111.52 130.19 55.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.211 0.529 . . . . 0.0 110.827 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 68.1 mmtt -121.56 152.91 38.71 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.733 -177.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.5 130.48 55.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 10' ' ' PRO . 16.0 tt -126.84 144.12 38.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' SER . . . . . 0.556 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 29.5 t -156.77 151.0 25.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.503 -175.763 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 13.8 tmtt? . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.725 -0.655 . . . . 0.0 110.078 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.8 mtt . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.39 18.07 79.19 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.845 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -154.5 120.84 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.528 HG23 HD23 ' A' ' 31' ' ' LEU . 67.7 mt -75.67 122.2 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.119 0.485 . . . . 0.0 111.883 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.445 HD23 ' HE2' ' A' ' 7' ' ' PHE . 11.1 mp -103.97 131.57 51.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.276 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.463 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 6.7 t -124.42 127.64 47.84 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.521 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HE2' HD23 ' A' ' 5' ' ' LEU . 93.5 m-85 -138.0 148.7 45.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.52 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.7 p -112.35 141.57 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.738 0.304 . . . . 0.0 110.714 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.3 mm -117.15 122.74 30.82 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 121.114 0.483 . . . . 0.0 110.361 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.25 143.59 17.69 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.013 2.475 . . . . 0.0 111.754 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.68 141.84 38.58 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 121.988 1.792 . . . . 0.0 110.328 175.151 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.412 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.9 m -80.05 156.22 27.2 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.36 -174.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.99 -42.91 69.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.779 0.323 . . . . 0.0 110.266 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -61.68 -45.7 92.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.191 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -62.28 -44.47 96.45 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.972 0.415 . . . . 0.0 110.776 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 12' ' ' SER . 54.8 mt -65.52 -29.44 47.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.54 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -71.49 -39.71 70.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 20.7 mt -67.0 -48.41 68.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.093 -176.324 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -89.52 -23.11 22.12 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.163 -175.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 64.04 19.22 11.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.963 -175.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.4 m -137.74 134.24 35.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.895 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.38 141.36 30.05 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 10.0 p30 -127.27 137.41 52.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.149 0.499 . . . . 0.0 109.899 -176.265 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 84.6 mt -95.86 126.52 41.18 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.687 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 m -120.05 132.47 55.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.835 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 39.7 t -123.1 137.39 54.93 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.73 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 27' ' ' LEU . 2.5 tm? -117.55 123.19 45.64 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 87' ' ' VAL . 22.7 t -122.56 119.63 58.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.036 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.2 t -137.15 178.75 6.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.611 -172.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 61.08 30.19 19.33 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.691 0.619 . . . . 0.0 111.742 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 37' ' ' LEU . 44.3 mt -62.15 126.31 26.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -26.84 68.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.336 0.589 . . . . 0.0 110.154 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p -127.77 94.95 4.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.285 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -77.43 63.93 2.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.3 0.571 . . . . 0.0 111.287 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 6.9 tt0 -99.76 -80.92 0.47 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.018 177.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.7 p -132.97 161.48 34.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.664 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 31' ' ' LEU . 63.9 tp -156.15 147.48 22.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.069 0.461 . . . . 0.0 110.996 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -127.45 152.75 47.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.715 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.8 mm -120.95 137.13 55.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 25.4 m -130.12 130.03 44.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.764 0.316 . . . . 0.0 111.226 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 70.9 m95 -117.31 141.91 47.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.523 175.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.38 156.3 40.43 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.631 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.465 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 19.6 m -74.98 158.84 32.59 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -54.08 -30.85 49.9 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.047 0.451 . . . . 0.0 111.277 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -73.4 -1.56 18.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.96 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.84 21.37 47.02 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.073 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 37.9 mt-10 -99.95 122.04 52.07 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.6 Cg_exo -58.67 137.9 82.72 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.859 2.373 . . . . 0.0 112.385 -176.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.426 HD23 ' HA ' ' A' ' 49' ' ' LEU . 10.9 mt -103.51 146.55 28.36 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.99 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.79 105.87 0.5 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.227 175.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.9 m -120.83 136.58 54.88 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.658 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -119.41 123.0 43.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.414 0.626 . . . . 0.0 110.478 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 54.1 mt -133.67 127.89 53.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.713 -1.13 . . . . 0.0 109.972 -175.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.49 ' HG3' HG23 ' A' ' 55' ' ' VAL . 20.6 tptm -97.09 122.87 40.57 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.914 177.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.778 HG12 ' H ' ' A' ' 57' ' ' GLU . 41.5 t 80.16 123.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.967 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -81.0 10.93 4.45 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.712 0.768 . . . . 0.0 110.819 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.778 ' H ' HG12 ' A' ' 55' ' ' VAL . 36.8 tt0 -122.52 154.07 38.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.571 -178.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 p -75.75 145.98 40.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 16.3 m170 -91.78 127.59 49.42 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -171.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 97.7 Cg_endo -103.87 22.46 0.13 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.762 2.975 . . . . 0.0 113.006 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -112.99 115.84 29.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.103 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.6 -53.96 4.32 Favored Glycine 0 CA--C 1.517 0.178 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.669 -176.225 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.5 m -123.29 168.71 12.13 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -115.75 24.47 11.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.371 0.605 . . . . 0.0 110.127 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 m -119.5 170.92 8.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.644 -172.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.53 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -110.52 151.65 27.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.476 171.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.4 mtmt -131.63 140.49 49.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.078 0.466 . . . . 0.0 110.153 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.488 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -117.19 125.92 6.73 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 174.362 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 54.2 t -108.63 120.84 60.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.818 0.342 . . . . 0.0 110.426 -178.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -114.46 140.17 48.93 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.895 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.3 m -99.39 115.03 28.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.152 0.501 . . . . 0.0 110.445 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -119.69 166.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.053 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.404 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 21.6 m -82.11 137.26 35.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.96 -28.54 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.917 177.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.42 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 23.6 mt-10 -56.99 -42.2 79.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.621 176.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 46.1 m-20 -63.08 -47.85 81.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 109.904 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.427 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -63.56 -39.0 93.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.328 177.766 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -69.45 -28.65 66.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.76 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -94.48 12.64 26.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 64.7 36.87 7.92 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.283 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.81 163.74 26.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.038 0.447 . . . . 0.0 110.539 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -130.71 139.34 50.29 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.595 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 83.9 m-85 -121.52 162.04 21.24 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.215 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 75.0 t -122.94 126.54 73.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.99 0.424 . . . . 0.0 111.073 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 48.5 t -106.4 136.89 45.36 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 173.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.477 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -124.36 129.57 50.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.767 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 28' ' ' VAL . 38.9 t -102.27 126.63 56.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.668 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.1 p -117.43 93.58 4.22 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.473 0.654 . . . . 0.0 110.673 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.534 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 74.8 t60 -99.46 -7.13 26.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.181 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 89' ' ' HIS . 37.6 ptt85 65.08 -11.79 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.476 1.51 . . . . 0.0 112.537 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.534 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 16.0 t70 -76.27 -33.95 59.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.467 0.651 . . . . 0.0 110.304 -174.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.89 153.68 37.73 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.564 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.23 -23.63 11.67 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.083 2.522 . . . . 0.0 112.55 -178.391 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.487 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 15.9 m -132.02 114.78 15.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.917 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.487 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 14.3 Cg_endo -56.84 141.15 92.88 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.933 2.422 . . . . 0.0 111.913 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -89.65 127.1 35.87 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.458 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.9 ptpt -108.22 140.76 40.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.359 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 6' ' ' THR . 62.3 mmtt -127.37 139.97 52.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.978 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -101.67 136.99 40.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.709 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 tt -131.38 138.87 52.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.866 0.365 . . . . 0.0 110.956 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.6 t -154.53 149.99 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.581 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.427 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 53.4 tttm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.452 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.747 0.308 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.25 60.55 0.41 Allowed Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -113.64 120.27 40.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 31' ' ' LEU . 54.4 mt -60.28 126.93 18.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.36 130.92 52.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.164 0.507 . . . . 0.0 110.673 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -112.56 119.46 38.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.066 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.574 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 58.1 m-85 -119.77 135.37 54.87 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.722 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.4 p -113.67 132.43 55.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.818 0.342 . . . . 0.0 110.533 177.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.64 124.79 28.58 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.189 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.31 140.44 58.5 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.775 2.317 . . . . 0.0 111.518 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HB2' HD11 ' A' ' 16' ' ' ILE . 18.2 Cg_endo -59.05 162.03 14.59 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.271 2.647 . . . . 0.0 113.071 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.507 ' O ' HG13 ' A' ' 16' ' ' ILE . 40.7 t -78.73 114.24 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.351 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.548 ' HA ' HD12 ' A' ' 16' ' ' ILE . 32.7 t80 -56.7 -35.32 68.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.568 -171.421 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -44.76 70.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.992 0.425 . . . . 0.0 111.049 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.56 -33.67 76.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.03 -176.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.8 mt -57.85 -40.19 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.909 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -72.36 -39.33 68.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.465 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.14 -48.01 59.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.448 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.7 m -78.26 -12.82 60.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.969 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp 66.24 7.88 5.18 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.046 -176.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.9 m -138.41 134.69 34.43 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.993 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.679 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -80.57 165.4 22.13 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.688 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 25.2 m120 -139.76 151.79 46.08 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.708 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 80.9 mt -114.01 119.69 38.05 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.211 -177.139 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.7 m -105.02 123.42 47.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.311 0.577 . . . . 0.0 111.312 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.44 ' HG ' ' HG ' ' A' ' 85' ' ' CYS . 42.2 t -109.83 137.06 48.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.267 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 1.3 tm? -127.5 122.55 33.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.039 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.14 120.95 54.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.744 0.306 . . . . 0.0 110.561 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 t -137.93 178.09 7.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.448 -175.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 59.14 42.01 19.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.564 0.54 . . . . 0.0 112.182 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 4' ' ' ILE . 16.3 mt -71.9 124.06 24.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 175.554 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.423 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . -62.18 -43.43 98.85 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.41 -178.538 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.475 HG22 ' OD2' ' A' ' 91' ' ' ASP . 3.4 t -110.5 110.43 21.16 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 169.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -85.99 110.29 19.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.478 0.656 . . . . 0.0 111.07 -175.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -140.48 -151.92 0.39 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.98 -178.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.3 m -72.86 144.63 47.37 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.776 HD23 ' HB3' ' A' ' 66' ' ' ALA . 57.0 tp -130.18 150.39 51.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.052 0.453 . . . . 0.0 110.951 -178.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -111.07 147.2 35.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.644 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.569 ' HB ' HD13 ' A' ' 53' ' ' ILE . 30.4 mm -119.79 137.31 54.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 176.664 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' THR . 22.6 t -143.28 138.75 29.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.045 -0.662 . . . . 0.0 111.457 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.512 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 86.3 m95 -126.22 143.23 51.22 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.605 177.014 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.39 160.4 43.46 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.487 ' HB2' ' OE1' ' A' ' 47' ' ' GLU . 18.7 m -87.59 160.13 18.3 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 pt20 -54.36 -37.32 64.81 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.424 ' HB3' ' OE1' ' A' ' 47' ' ' GLU . 10.6 t -85.59 6.61 26.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.016 0.436 . . . . 0.0 110.995 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.93 23.59 24.96 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.547 173.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.487 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 3.2 mp0 -84.51 122.12 75.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.234 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.6 136.73 64.69 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.419 2.079 . . . . 0.0 111.72 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -113.68 139.78 48.78 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.645 -176.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.55 106.66 2.23 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.895 177.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 8.9 m -115.31 114.07 24.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.931 -176.892 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -100.86 119.81 39.22 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.574 -178.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.569 HD13 ' HB ' ' A' ' 39' ' ' ILE . 7.4 mt -135.5 137.97 48.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.88 -169.87 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.468 ' O ' ' HG3' ' A' ' 54' ' ' LYS . 7.3 ptpp? -131.12 106.03 8.09 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.769 0.795 . . . . 0.0 110.078 164.002 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.543 HG22 HG22 ' A' ' 53' ' ' ILE . 3.4 m -146.28 95.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.219 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -73.4 -22.03 60.35 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.226 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -155.92 155.03 32.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.771 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -78.05 135.23 37.71 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -95.28 126.5 45.91 Favored Pre-proline 0 C--N 1.32 -0.71 0 C-N-CA 119.941 -0.703 . . . . 0.0 111.865 -168.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -104.54 0.43 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.71 2.94 . . . . 0.0 111.278 162.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -128.96 130.99 47.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.532 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.17 -53.27 3.05 Favored Glycine 0 CA--C 1.518 0.236 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.2 m -122.98 164.14 19.1 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -120.84 23.87 10.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 117.892 0.315 . . . . 0.0 110.978 -177.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 p -161.83 174.35 13.29 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -169.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.776 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -106.74 145.27 32.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.184 167.981 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -131.21 138.25 49.29 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.98 0.419 . . . . 0.0 110.072 -176.087 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.532 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -146.89 136.72 6.3 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 176.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.708 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 5.6 m -116.95 149.94 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 117.319 0.559 . . . . 0.0 111.342 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 51' ' ' THR . . . -114.59 150.39 35.09 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.427 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -98.33 114.73 27.15 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 122.105 0.955 . . . . 0.0 110.063 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.1 t -119.41 153.36 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.628 0 CA-C-N 113.401 -1.727 . . . . 0.0 109.383 -173.513 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -83.98 141.1 31.46 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.5 p -53.16 -33.13 19.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-O 121.057 0.456 . . . . 0.0 109.901 176.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -55.62 -36.64 67.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.423 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -68.15 -51.91 40.62 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.122 0.487 . . . . 0.0 109.974 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.478 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -66.73 -34.96 79.0 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.515 -177.982 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 32.3 t30 -71.73 -22.16 61.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.71 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -101.33 8.88 42.14 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.829 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 64.99 37.91 6.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.25 151.1 13.21 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.48 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -109.06 138.11 45.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.448 172.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.478 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.1 m-85 -127.6 156.05 42.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.162 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.533 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.5 t -119.17 127.37 75.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.608 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.512 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 49.9 t -105.47 130.94 53.44 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.547 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -125.54 122.41 36.45 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.552 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.0 t -108.55 127.37 65.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.769 0.319 . . . . 0.0 111.004 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.487 HG22 ' HB3' ' A' ' 95' ' ' PRO . 23.3 p -122.16 108.82 13.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.102 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.498 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 84.9 t60 -98.43 -50.99 4.11 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.977 -176.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 37.6 ttt-85 128.55 -20.5 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 O-C-N 125.178 1.549 . . . . 0.0 107.735 -163.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.557 ' HB3' HD11 ' A' ' 4' ' ' ILE . 12.2 t70 -73.32 -37.32 66.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.314 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.15 152.14 75.45 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.281 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.32 -23.33 13.38 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.433 2.755 . . . . 0.0 112.86 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 36.7 m -125.59 109.93 25.78 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.547 ' HB2' HG22 ' A' ' 86' ' ' THR . 14.1 Cg_endo -56.8 142.11 92.31 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 123.026 2.484 . . . . 0.0 112.528 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 86' ' ' THR . 41.3 mt-30 -80.94 131.37 35.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.161 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -109.46 127.89 54.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.303 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 57.6 mmtt -122.64 133.74 54.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -178.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.0 m-85 -100.91 132.71 46.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 13.7 tt -126.63 139.02 52.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.099 0.476 . . . . 0.0 111.255 -178.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.1 p -158.02 149.45 21.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.613 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.874 178.672 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.512 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . 56.7 mtt . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.088 0.47 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.81 170.32 18.38 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -177.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 30' ' ' ASN . 33.1 t70 -94.11 110.64 22.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 117.3 0.55 . . . . 0.0 110.426 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 31' ' ' LEU . 66.2 mt -63.13 124.38 17.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.933 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.76 130.81 49.85 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.222 0.534 . . . . 0.0 109.877 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.7 m -114.66 118.29 33.25 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.005 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.69 142.68 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.176 0.513 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -119.29 131.61 55.78 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.122 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 37.1 mm -117.88 124.97 28.34 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.302 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 33.6 Cg_endo -64.35 143.64 83.47 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 122.738 2.292 . . . . 0.0 111.798 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.571 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 44.8 Cg_endo -65.77 152.12 82.49 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.674 2.249 . . . . 0.0 111.825 178.031 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.477 ' O ' HG13 ' A' ' 16' ' ' ILE . 34.3 t -78.23 124.29 27.91 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.645 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.36 -29.55 69.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.409 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.39 77.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.216 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.9 -45.83 76.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.19 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 22' ' ' ALA . 73.2 mt -56.99 -33.09 41.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 121.147 0.499 . . . . 0.0 110.693 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -66.46 -43.77 84.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -76.98 -49.38 15.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.543 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 m -74.14 -19.51 60.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.915 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt 67.44 7.11 5.33 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.249 0.619 . . . . 0.0 111.198 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.7 t -139.17 153.56 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.501 -0.772 . . . . 0.0 108.952 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.551 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -93.67 142.67 27.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.587 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 42.5 m-80 -131.19 112.42 12.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.12 0.486 . . . . 0.0 110.458 -173.731 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.7 mt -78.74 143.36 36.25 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.941 -177.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.483 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 28.0 m -125.59 123.0 38.08 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.336 0.588 . . . . 0.0 110.758 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 36.6 t -114.15 131.96 56.25 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.445 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD23 ' HE3' ' A' ' 67' ' ' LYS . 3.2 tm? -118.91 124.67 47.65 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -177.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.54 ' O ' ' HB3' ' A' ' 65' ' ' SER . 14.5 t -120.18 119.74 60.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.5 t -134.04 177.63 7.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.673 -173.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 1.1 t30 58.5 45.93 15.72 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.558 0.536 . . . . 0.0 111.447 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.646 HD13 ' HE1' ' A' ' 89' ' ' HIS . 17.7 mt -71.48 146.36 48.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.209 -175.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 1' ' ' MET . . . -86.45 -48.92 7.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.502 -171.206 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.4 p -92.42 -102.89 0.12 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.25 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -109.55 -170.87 1.73 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.505 -175.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.533 ' HG3' ' HG3' ' A' ' 57' ' ' GLU . 3.4 pm0 -86.48 5.34 35.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.605 0.24 . . . . 0.0 111.48 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.4 m -64.31 103.82 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.814 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 38' ' ' ASN . 1.0 OUTLIER -144.3 151.34 39.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.164 0.507 . . . . 0.0 110.49 -177.071 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.684 ' H ' HD23 ' A' ' 37' ' ' LEU . 74.3 m-20 -140.07 149.89 43.68 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.014 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.608 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.0 mm -120.19 136.83 55.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.4 t -137.3 131.59 32.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.97 0.414 . . . . 0.0 110.382 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.512 ' HD1' HG21 ' A' ' 51' ' ' THR . 62.3 m95 -112.8 149.91 32.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.27 163.71 39.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.178 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 31.9 t -88.13 171.84 9.95 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.835 175.529 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -55.48 -29.94 59.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.137 0.494 . . . . 0.0 111.367 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -73.53 -8.62 56.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.922 0.392 . . . . 0.0 111.108 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.66 16.08 55.52 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.456 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 12.5 pt-20 -94.31 126.97 46.27 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -174.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.26 135.46 62.0 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.012 2.475 . . . . 0.0 113.565 -172.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.497 HD11 ' CD1' ' A' ' 83' ' ' PHE . 9.8 mt -97.37 147.8 23.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.02 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.69 106.51 3.55 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.886 0.851 . . . . 0.0 110.177 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.614 HG22 HD11 ' A' ' 53' ' ' ILE . 16.5 m -143.89 114.13 7.41 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.908 -1.496 . . . . 0.0 109.382 -175.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.0 tttp -109.17 116.64 32.31 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 118.751 -1.179 . . . . 0.0 111.512 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.614 HD11 HG22 ' A' ' 51' ' ' THR . 0.6 OUTLIER -137.2 119.23 19.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 167.706 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.577 ' O ' HG13 ' A' ' 55' ' ' VAL . 49.2 tptt -110.9 103.55 12.06 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.678 177.171 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.604 ' HB ' ' H ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -170.91 151.79 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 124.296 0.997 . . . . 0.0 110.567 -177.854 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.1 mtt -107.8 9.75 28.87 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 166.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.604 ' H ' ' HB ' ' A' ' 55' ' ' VAL . 42.7 tt0 -137.52 145.87 43.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.268 -1.333 . . . . 0.0 110.265 -167.018 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.6 m -78.64 154.3 30.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -94.43 127.88 42.45 Favored Pre-proline 0 CA--C 1.516 -0.342 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.223 -173.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.508 ' HA ' ' O ' ' A' ' 63' ' ' THR . 93.0 Cg_endo -94.76 42.11 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.322 2.681 . . . . 0.0 112.772 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 54.1 t30 -101.35 96.3 7.08 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.45 -41.28 2.48 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.951 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.508 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -123.22 165.23 17.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.294 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -100.78 23.16 10.93 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.781 0.801 . . . . 0.0 109.351 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.54 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 14.6 m -112.15 173.89 6.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.566 -168.402 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.493 ' HB3' HD13 ' A' ' 37' ' ' LEU . . . -106.99 143.16 35.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.557 ' HE3' HD23 ' A' ' 27' ' ' LEU . 56.7 mttp -129.74 139.92 51.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.608 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -124.88 123.97 5.22 Favored Glycine 0 N--CA 1.44 -1.075 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 62.0 t -106.93 123.33 61.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.979 0.418 . . . . 0.0 109.971 -177.663 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.587 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -113.46 136.12 53.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.063 -177.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 p -98.16 113.54 25.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.493 -177.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.509 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m -119.47 164.44 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.155 -175.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.477 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 42.5 m -74.99 140.67 43.79 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.451 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -61.54 -32.22 52.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.551 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 5.5 mm-40 -60.22 -33.94 72.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.229 177.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.477 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 4.7 m-20 -62.16 -44.81 95.78 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -74.31 -34.85 63.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.435 -179.733 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.441 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 82.7 m-20 -64.29 -32.54 74.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.756 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -92.56 6.65 46.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.928 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 58.33 38.25 25.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -66.05 166.09 12.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.406 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 101' ' ' SER . 26.6 tt0 -123.27 139.19 54.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.084 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.497 ' CD1' HD11 ' A' ' 49' ' ' LEU . 79.2 m-85 -121.81 163.75 18.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.341 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.467 HG22 ' CD1' ' A' ' 99' ' ' PHE . 89.3 t -128.42 128.08 67.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.474 -176.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.737 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 25.9 p -105.89 142.81 34.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.544 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -123.53 127.31 48.15 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.765 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.485 HG11 HG11 ' A' ' 28' ' ' VAL . 60.3 t -106.47 127.26 61.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.079 -177.21 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -126.84 102.28 6.96 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.318 0.58 . . . . 0.0 109.493 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.761 ' HD2' ' HB2' ' A' ' 91' ' ' ASP . 40.9 t60 -98.52 -9.99 24.16 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.04 -174.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER 71.07 11.43 6.95 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.831 0.824 . . . . 0.0 109.042 -174.306 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.761 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 7.0 t70 -92.66 -37.25 12.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.5 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -122.63 155.57 62.71 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.733 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.43 -31.79 10.87 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.811 2.341 . . . . 0.0 112.551 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 92' ' ' LEU . 22.2 p -113.04 110.25 51.57 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.63 -177.198 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.544 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.5 Cg_endo -62.64 141.79 87.15 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.765 2.31 . . . . 0.0 111.892 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.15 136.16 34.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.45 -176.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -107.22 132.61 52.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.212 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.737 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -124.95 140.86 52.54 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.725 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.467 ' CD1' HG22 ' A' ' 84' ' ' VAL . 70.3 m-85 -104.83 141.08 37.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.142 -177.934 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.4 tt -140.5 137.32 36.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.805 0.336 . . . . 0.0 110.602 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 22.8 t -157.89 150.33 22.46 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 1.1 tmmt? . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.336 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.54 ' O ' ' HA ' ' A' ' 32' ' ' ALA . 49.1 ttm . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.538 ' HA2' ' HB2' ' A' ' 32' ' ' ALA . . . -112.27 -158.92 14.36 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.719 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 63.17 86.24 0.12 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 110.939 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.531 HG23 HD23 ' A' ' 31' ' ' LEU . 81.9 mt -60.32 122.29 10.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.792 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.6 mt -107.63 132.2 53.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.145 0.497 . . . . 0.0 110.877 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.483 HG22 HG21 ' A' ' 87' ' ' VAL . 33.4 p -107.66 127.11 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.268 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -124.73 152.8 43.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.709 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.0 p -134.12 138.29 45.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.574 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -117.9 123.06 29.93 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.606 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.487 ' HA ' HD11 ' A' ' 100' ' ' ILE . 72.1 Cg_endo -75.32 140.15 24.27 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.129 2.552 . . . . 0.0 111.819 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HG2' HD11 ' A' ' 16' ' ' ILE . 73.7 Cg_endo -70.86 150.56 61.69 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.289 1.993 . . . . 0.0 111.754 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -78.73 144.7 34.99 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.114 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.39 -31.33 71.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.089 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.03 93.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.312 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.68 -47.24 84.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.974 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.407 HD11 ' HG2' ' A' ' 11' ' ' PRO . 57.6 mt -63.35 -34.14 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.497 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -73.28 -45.69 54.23 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.758 -175.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.0 -49.37 37.59 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.669 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.8 m -80.38 -15.83 55.91 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.158 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.8 mttp 62.16 19.6 11.04 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.299 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.7 m -141.09 154.72 46.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.372 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.764 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -104.53 162.39 13.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -146.84 145.91 30.03 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.559 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 69.4 mt -107.17 128.01 54.02 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.233 -177.134 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.7 m -115.54 126.8 54.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.163 0.506 . . . . 0.0 111.098 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.671 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 32.7 t -126.62 138.45 53.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.525 HD12 ' HG2' ' A' ' 67' ' ' LYS . 2.5 tt -132.34 135.82 46.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.235 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' SER . 42.1 t -118.18 125.59 74.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.372 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.4 m -127.94 176.38 7.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.295 -176.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 59.66 41.34 18.79 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.101 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 HG23 ' A' ' 4' ' ' ILE . 34.7 mt -80.49 126.85 31.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.549 177.39 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.54 ' HA ' ' O ' ' A' ' 1' ' ' MET . . . -66.98 -28.05 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.634 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 66.6 p -138.38 170.21 16.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.458 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -137.16 57.37 1.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.205 0.526 . . . . 0.0 111.831 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.2 mp0 -75.31 -59.13 2.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 171.031 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.7 t -169.14 147.57 3.84 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.083 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' ' 38' ' ' ASN . 2.2 tm? -136.98 154.14 50.5 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.647 ' N ' HD13 ' A' ' 37' ' ' LEU . 18.8 m120 -130.83 148.54 52.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.027 -174.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.656 ' HB ' HD11 ' A' ' 53' ' ' ILE . 20.6 mm -119.36 134.97 61.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 172.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.7 t -143.34 126.99 17.0 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.069 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 87.7 m95 -105.15 148.35 26.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.2 0.524 . . . . 0.0 110.382 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.56 158.23 40.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.507 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.41 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 32.3 t -75.68 162.58 28.11 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 66.4 tp60 -58.09 -25.16 60.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.258 0.551 . . . . 0.0 110.296 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.3 m -72.95 -8.56 56.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.133 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.17 19.2 43.3 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.283 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -100.03 123.57 46.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.516 0.198 . . . . 0.0 110.868 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.08 141.69 96.77 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.317 2.678 . . . . 0.0 113.276 -176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.9 mt -113.21 147.38 37.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.168 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 21.9 tt0 -56.78 107.52 0.4 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.587 176.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.2 m -118.86 113.85 21.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.299 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 pttt -115.84 125.76 53.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.292 0.568 . . . . 0.0 111.175 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.656 HD11 ' HB ' ' A' ' 39' ' ' ILE . 28.2 mt -133.27 138.52 51.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.614 -174.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.0 134.68 40.04 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.661 HG12 ' H ' ' A' ' 57' ' ' GLU . 21.7 t 68.56 112.25 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.003 -175.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.97 10.96 2.96 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.855 0.836 . . . . 0.0 110.593 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.661 ' H ' HG12 ' A' ' 55' ' ' VAL . 36.0 tt0 -122.1 156.1 34.3 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 p -74.68 142.96 44.42 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.955 0.407 . . . . 0.0 110.281 -171.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -92.22 129.41 41.43 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.065 -166.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 63' ' ' THR . 91.8 Cg_endo -93.86 -174.39 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.094 2.53 . . . . 0.0 112.878 176.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 m120 56.87 80.76 0.15 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.882 0.739 . . . . 0.0 112.048 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.25 -11.57 60.14 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.725 HG22 ' H ' ' A' ' 65' ' ' SER . 3.7 m -145.7 157.15 43.98 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -131.81 23.36 4.63 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 171.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.725 ' H ' HG22 ' A' ' 63' ' ' THR . 2.0 m -136.96 173.54 11.59 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.288 -1.323 . . . . 0.0 111.975 -162.0 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -108.27 149.3 28.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.071 174.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.525 ' HG2' HD12 ' A' ' 27' ' ' LEU . 28.9 mtpp -131.69 139.37 49.02 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.36 129.2 4.61 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.926 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 42.1 t -115.23 132.06 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.788 0.328 . . . . 0.0 110.714 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.32 151.65 35.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.167 177.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -99.33 120.74 40.06 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.592 0.71 . . . . 0.0 110.38 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.764 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.0 t -124.25 151.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.083 -174.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -88.57 153.27 21.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -60.87 -36.75 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.191 0.52 . . . . 0.0 109.98 -177.585 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 9.9 mm-40 -57.54 -33.88 68.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.778 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.21 -48.33 80.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.535 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -68.78 -36.24 78.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.756 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 87.6 m-20 -64.24 -34.35 77.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.974 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -87.53 7.12 30.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.666 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 80' ' ' ARG . 23.2 mmt180 56.58 37.81 29.11 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.76 178.311 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -63.5 159.08 19.31 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.651 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -111.63 138.07 48.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.842 175.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.41 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 68.5 m-85 -122.42 154.26 37.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.29 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.511 HG22 ' CD1' ' A' ' 99' ' ' PHE . 86.2 t -123.59 128.19 74.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -173.521 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 28.9 p -106.15 140.27 39.38 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.662 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.477 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -119.19 127.02 52.91 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.773 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.483 HG21 HG22 ' A' ' 6' ' ' THR . 58.6 t -110.26 133.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.817 -178.056 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.0 p -139.06 100.67 4.09 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.176 0.512 . . . . 0.0 111.066 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.521 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 50.2 t60 -98.4 -8.19 27.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.03 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 52.2 ttt180 79.7 -27.6 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.782 0.676 . . . . 0.0 110.738 -176.183 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -71.17 -33.11 69.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.087 0.47 . . . . 0.0 110.75 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.44 HD12 ' O ' ' A' ' 92' ' ' LEU . 0.9 OUTLIER -87.89 146.44 38.78 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-O 121.203 0.525 . . . . 0.0 110.752 177.489 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.62 -19.54 11.31 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.288 2.658 . . . . 0.0 112.813 -175.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 20.1 m -141.25 132.52 13.53 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.555 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 27.3 Cg_exo -61.85 140.99 88.38 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.497 2.131 . . . . 0.0 111.514 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -92.75 128.56 38.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.903 0.382 . . . . 0.0 110.456 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.477 ' HG2' HG23 ' A' ' 86' ' ' THR . 56.5 mtpt -106.11 141.62 37.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.679 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 30.3 mmtm -129.85 138.98 51.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.292 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.511 ' CD1' HG22 ' A' ' 84' ' ' VAL . 15.7 m-30 -100.98 137.56 39.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.86 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.6 tt -130.48 139.45 51.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.958 0.409 . . . . 0.0 110.722 177.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.5 p -157.38 148.7 21.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.219 176.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.463 ' HB2' ' NE1' ' A' ' 77' ' ' TRP . 27.1 tptp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.687 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.9 mtm . . . . . 0 N--CA 1.482 1.166 0 CA-C-O 120.803 0.335 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 149.08 179.09 24.67 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.072 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.11 125.95 52.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.152 0.501 . . . . 0.0 111.664 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.581 HG23 HD23 ' A' ' 31' ' ' LEU . 84.0 mt -63.29 135.95 26.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.437 174.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.6 mt -104.54 130.79 52.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.929 0.395 . . . . 0.0 110.29 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.0 p -116.86 122.57 44.74 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.14 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -121.1 133.92 55.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.48 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 p -112.14 134.48 53.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.22 176.896 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.51 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 34.0 mm -117.42 119.93 33.89 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.574 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.51 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 18.1 Cg_endo -58.31 139.59 91.12 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.996 2.464 . . . . 0.0 111.802 173.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.523 ' HB2' HD11 ' A' ' 16' ' ' ILE . 43.6 Cg_endo -65.96 153.14 79.34 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 123.118 2.546 . . . . 0.0 112.905 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.499 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.0 t -81.09 121.41 26.06 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 178.152 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' A' ' 16' ' ' ILE . 51.8 t80 -62.83 -34.08 76.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.105 -173.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.413 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -61.98 -46.41 89.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.449 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.25 -38.86 88.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.568 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.585 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.6 mt -58.9 -40.68 80.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.52 176.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -73.6 -43.56 59.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.073 -176.227 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -62.86 -48.71 77.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.952 -177.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.2 p -86.94 -13.95 43.22 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.176 0.512 . . . . 0.0 111.07 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.81 27.06 16.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.049 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.4 m -139.08 134.0 32.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.144 174.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.585 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -87.51 142.65 27.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 39.2 m-80 -126.55 118.41 24.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.009 0.433 . . . . 0.0 110.091 -173.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.546 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 86.9 mt -82.82 139.15 33.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.959 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 30.2 m -124.9 120.62 32.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.477 0.656 . . . . 0.0 110.937 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 42.5 t -121.48 136.67 54.94 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.413 178.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HG ' ' OG ' ' A' ' 65' ' ' SER . 2.7 tt -131.81 130.75 42.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.531 HG11 HG21 ' A' ' 87' ' ' VAL . 12.8 t -120.76 119.5 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.687 -176.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.1 p -130.86 177.13 7.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.043 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.2 45.28 17.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.298 0.57 . . . . 0.0 111.189 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.677 HD11 HD22 ' A' ' 37' ' ' LEU . 25.4 mt -78.16 110.5 13.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.352 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.39 -50.85 62.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.407 -172.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.543 HG22 ' HB2' ' A' ' 91' ' ' ASP . 5.7 t -90.23 148.73 22.74 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.986 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -93.91 105.15 17.18 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.53 0.681 . . . . 0.0 109.968 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.467 ' HG2' ' HB3' ' A' ' 90' ' ' ARG . 9.5 tp10 -151.92 174.99 12.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.248 -169.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' HG3' ' A' ' 35' ' ' GLU . 9.3 t -60.99 146.18 47.99 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 173.115 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.677 HD22 HD11 ' A' ' 31' ' ' LEU . 48.7 tp -125.13 142.18 51.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.258 0.552 . . . . 0.0 110.289 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.21 144.45 51.04 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.202 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.646 HG21 ' HA3' ' A' ' 68' ' ' GLY . 16.0 mm -119.21 134.79 61.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 175.446 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.411 ' HB3' ' O ' ' A' ' 86' ' ' THR . 23.2 t -141.26 129.89 22.75 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 119.666 -0.814 . . . . 0.0 111.508 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.579 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -105.48 146.88 28.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.687 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.51 164.19 38.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.701 179.017 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.8 p -75.52 170.6 15.82 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -58.45 -28.51 65.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.139 0.495 . . . . 0.0 110.818 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.0 m -75.62 -8.21 56.22 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.219 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.7 21.43 43.49 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.347 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 0.8 OUTLIER -96.64 122.9 55.88 Favored Pre-proline 0 N--CA 1.443 -0.775 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.69 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 38.1 Cg_exo -59.78 139.63 89.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 123.024 2.483 . . . . 0.0 113.875 -172.307 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 7.1 mt -105.74 145.02 31.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.604 174.904 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -63.12 105.8 0.76 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.335 0.588 . . . . 0.0 110.325 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.42 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.2 m -112.12 134.88 53.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.269 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -109.32 122.99 48.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.017 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.597 HG12 ' HB ' ' A' ' 39' ' ' ILE . 4.5 mp -128.47 133.77 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.78 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 54' ' ' LYS . 43.5 tptt -97.22 116.69 29.88 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.724 HG12 ' H ' ' A' ' 57' ' ' GLU . 34.7 t 78.01 116.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 124.439 1.087 . . . . 0.0 110.811 -176.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.9 mmt -78.4 12.78 1.8 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.49 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.724 ' H ' HG12 ' A' ' 55' ' ' VAL . 33.3 mt-10 -121.3 154.72 36.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.83 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -77.41 145.15 37.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -176.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 33.6 m-70 -92.72 128.0 45.75 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.536 -0.466 . . . . 0.0 109.964 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.449 ' HD2' ' H ' ' A' ' 61' ' ' ASN . 53.0 Cg_endo -99.0 -31.3 0.03 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.11 2.54 . . . . 0.0 113.79 176.805 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.449 ' H ' ' HD2' ' A' ' 60' ' ' PRO . 9.9 p30 -114.41 142.07 46.83 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.729 0.3 . . . . 0.0 110.303 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.97 -56.63 4.83 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -177.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 m -126.56 153.51 45.13 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -111.39 23.0 14.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.385 0.612 . . . . 0.0 110.249 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.483 ' OG ' ' HG ' ' A' ' 27' ' ' LEU . 33.0 t -160.93 173.68 14.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -169.52 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.431 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.66 155.74 21.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.482 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.417 ' HG2' HD12 ' A' ' 27' ' ' LEU . 46.7 mttp -129.72 139.44 51.33 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 176.032 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.646 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -121.93 118.76 3.8 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.546 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 58.5 t -107.84 122.95 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.748 0.308 . . . . 0.0 110.451 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.33 141.06 48.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.902 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -98.87 114.6 27.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.28 0.562 . . . . 0.0 110.326 -177.026 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.5 m -119.73 166.77 13.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.774 -177.267 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.4 m -79.13 144.89 34.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.905 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 t -57.24 -30.85 36.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 173.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.96 -39.58 90.1 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.473 177.558 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -61.81 -42.35 98.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.558 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -73.02 -39.19 66.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 179.296 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -68.9 -23.95 64.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.639 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -98.02 16.8 19.97 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 17.4 mmt180 55.59 36.71 27.72 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.969 173.556 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -71.98 157.59 37.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.373 0.606 . . . . 0.0 111.958 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.558 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.4 mp0 -109.23 139.11 44.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.433 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.37 151.81 45.62 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.219 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.9 t -122.2 122.74 67.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.399 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 20.6 p -105.6 133.37 50.45 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.548 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -126.4 128.38 46.93 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -178.076 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 HG11 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -119.84 127.41 75.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.039 0.447 . . . . 0.0 112.155 -174.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.0 m -112.18 108.51 17.79 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.191 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -101.21 -8.81 21.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.091 177.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.467 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 13.0 ttt180 74.15 -3.84 2.43 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.333 0.587 . . . . 0.0 110.317 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.548 ' HB3' HD11 ' A' ' 4' ' ' ILE . 5.5 t70 -73.23 -36.32 66.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.569 -177.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -122.61 154.16 63.12 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.577 -176.563 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -68.08 -20.69 43.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.254 2.636 . . . . 0.0 112.476 -176.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.505 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 13.7 m -129.04 111.37 18.4 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.259 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.548 ' HB2' HG22 ' A' ' 86' ' ' THR . 11.8 Cg_endo -55.21 148.45 49.76 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.722 2.281 . . . . 0.0 110.919 174.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' THR . 40.9 mt-30 -90.8 127.42 36.34 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.759 -171.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 15.9 ptmt -110.14 129.92 55.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.304 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.726 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 67.6 mmtt -122.92 140.9 52.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.686 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -100.68 122.99 44.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.368 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.9 tt -122.86 139.29 50.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 3.7 p -157.47 148.87 21.82 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.245 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 49.5 tttp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.098 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.926 0.394 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.23 77.31 0.34 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -133.25 130.3 38.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -176.719 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.468 HG23 HD23 ' A' ' 31' ' ' LEU . 59.6 mt -66.95 120.5 14.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.391 0.432 . . . . 0.0 110.237 -176.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.5 mt -108.77 134.41 51.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.17 0.509 . . . . 0.0 111.192 -175.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.513 ' HB ' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -107.39 127.72 53.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.112 -177.904 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PHE . . . . . 0.54 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 94.9 m-85 -127.34 143.15 51.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -119.63 137.86 53.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.742 0.306 . . . . 0.0 110.664 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.17 123.46 30.05 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.995 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HA ' HD11 ' A' ' 100' ' ' ILE . 61.1 Cg_endo -70.91 148.73 58.22 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 123.124 2.549 . . . . 0.0 112.066 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.25 149.33 81.38 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.585 2.19 . . . . 0.0 111.75 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 16' ' ' ILE . 2.8 t -103.27 143.99 31.93 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.035 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -58.23 -30.59 66.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.458 -172.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -67.75 -44.18 78.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.782 0.325 . . . . 0.0 110.314 175.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.82 -45.95 91.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.16 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 12' ' ' SER . 51.9 mt -61.01 -29.89 46.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.363 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.95 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -72.3 -43.92 63.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.109 0.48 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.3 mm? -67.27 -49.53 63.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.262 -176.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 p -93.82 0.84 56.46 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 87.2 tttt 69.51 -48.9 0.61 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.4 0.68 . . . . 0.0 111.165 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 13.8 m -89.38 151.21 22.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.916 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.3 155.88 24.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.209 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -129.86 126.41 37.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.064 0.459 . . . . 0.0 110.588 -176.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.412 HD22 HD13 ' A' ' 100' ' ' ILE . 52.7 mt -89.39 138.45 31.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.81 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.559 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 19.2 m -120.8 129.2 53.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.018 0.437 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 47.0 t -109.75 137.38 47.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.169 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 2.8 tm? -126.34 123.73 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 87' ' ' VAL . 15.4 t -123.89 119.63 57.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.9 p -133.71 177.39 7.75 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -173.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 15.7 m120 59.46 40.74 20.32 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.428 177.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 37' ' ' LEU . 58.6 mt -64.1 127.43 31.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.187 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.82 -27.84 69.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.651 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.0 p -125.91 147.87 49.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.065 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -95.26 44.91 1.09 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.3 0.572 . . . . 0.0 110.56 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -91.27 -174.73 4.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.274 177.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.1 m -66.16 136.31 55.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.892 0.377 . . . . 0.0 110.587 176.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 31' ' ' LEU . 49.3 tp -115.43 151.29 35.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -135.0 161.72 34.49 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.511 HG21 ' HA3' ' A' ' 68' ' ' GLY . 27.8 mm -121.86 151.91 25.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -177.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 37.3 m -149.98 123.74 9.23 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.084 -0.385 . . . . 0.0 111.109 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 67.4 m95 -107.76 144.87 34.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.174 0.512 . . . . 0.0 111.246 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.76 157.07 34.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.067 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.679 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 14.7 m -88.26 162.65 16.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.046 0.45 . . . . 0.0 109.926 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.3 -25.05 8.52 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.891 -1.05 . . . . 0.0 113.821 -170.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -88.1 -0.78 57.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.857 0.361 . . . . 0.0 111.403 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.16 22.16 28.18 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.324 -0.465 . . . . 0.0 112.061 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.679 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 8.2 pt-20 -100.4 128.76 29.51 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.731 0.301 . . . . 0.0 110.595 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 35.7 Cg_exo -61.13 141.55 94.08 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.33 2.687 . . . . 0.0 113.77 -173.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.502 HD11 ' CD1' ' A' ' 83' ' ' PHE . 8.5 mt -108.19 147.71 30.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.959 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 4.2 mp0 -62.39 106.2 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.632 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.5 m -143.92 114.06 7.37 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -96.79 120.01 36.33 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.478 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 60.6 mt -134.99 119.27 26.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.075 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -130.24 105.28 7.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 164.286 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -143.75 136.9 24.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.449 0.642 . . . . 0.0 111.57 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.2 ttm -109.24 -25.11 10.77 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.901 171.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -124.44 156.02 37.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.281 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -78.51 160.76 27.49 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.542 ' HB3' ' OD1' ' A' ' 61' ' ' ASN . 73.6 m-70 -92.88 128.7 42.57 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -175.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 94.4 Cg_endo -94.73 25.42 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.91 2.407 . . . . 0.0 113.363 -177.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.542 ' OD1' ' HB3' ' A' ' 59' ' ' HIS . 3.3 p-10 -97.07 107.22 19.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.549 0.69 . . . . 0.0 110.735 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.37 -42.48 3.14 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.265 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -148.57 168.57 22.41 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -87.48 26.11 1.32 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.225 0.536 . . . . 0.0 111.294 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.567 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 17.3 m -110.92 173.59 6.26 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -165.303 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.62 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -106.69 146.0 31.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.861 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 55.6 mtpt -132.48 140.76 48.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.462 -175.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.511 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -129.33 139.37 10.91 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 53.6 t -114.44 124.5 71.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.0 0.429 . . . . 0.0 110.79 -174.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -115.69 134.64 54.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.83 177.834 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.8 m -98.92 123.38 43.16 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.081 0.467 . . . . 0.0 110.166 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' SER . 4.0 m -122.03 165.32 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.929 -175.836 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.1 t -86.69 150.06 24.45 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 t -63.82 -24.28 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -65.14 -36.53 84.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.731 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.451 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 59.7 m-20 -68.18 -44.67 75.4 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.442 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -69.18 -35.28 76.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.478 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -70.54 -27.7 64.35 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.587 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -92.94 7.67 43.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.918 0.39 . . . . 0.0 110.326 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.9 mtt-85 58.34 37.49 25.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.28 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 53.3 mtpt -67.1 156.48 36.03 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.977 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.51 139.23 43.55 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.273 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.502 ' CD1' HD11 ' A' ' 49' ' ' LEU . 64.8 m-85 -124.71 150.62 45.98 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.128 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 94.7 t -125.27 131.47 72.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.752 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 30.6 p -106.31 126.28 52.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.48 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.569 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 1.4 p -112.05 137.64 49.81 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.658 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 28' ' ' VAL . 44.7 t -116.59 127.42 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.603 -175.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 95' ' ' PRO . 1.4 p -119.02 94.22 4.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.692 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 1.3 t60 -85.34 -50.78 7.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.33 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.692 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 3.2 tmm_? 151.69 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.758 1.286 . . . . 0.0 108.307 -176.737 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -71.37 -30.41 66.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.662 -1.154 . . . . 0.0 112.177 -167.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.32 148.23 43.41 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-O 121.105 0.479 . . . . 0.0 111.067 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -78.61 -26.86 5.47 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.271 2.647 . . . . 0.0 111.96 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.6 p -118.39 122.3 30.28 Favored Pre-proline 0 N--CA 1.445 -0.684 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.518 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.569 ' HB2' ' HB ' ' A' ' 86' ' ' THR . 18.7 Cg_endo -60.5 140.72 92.83 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.198 1.932 . . . . 0.0 111.997 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.544 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.9 pt20 -78.94 135.11 36.86 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -113.31 128.01 56.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.315 0.579 . . . . 0.0 111.782 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.513 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 6.2 tmtt? -121.98 140.91 51.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.178 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -100.35 147.55 25.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.836 0.35 . . . . 0.0 111.101 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.6 tt -133.77 138.55 50.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.455 176.427 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 56.9 p -158.3 149.94 21.34 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.65 -0.69 . . . . 0.0 110.26 179.254 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tpt . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.904 0.383 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.863 ' HA3' ' HB2' ' A' ' 32' ' ' ALA . . . 174.38 56.42 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.612 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -68.62 118.47 11.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.689 0.281 . . . . 0.0 110.678 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.54 HG23 HD23 ' A' ' 31' ' ' LEU . 69.3 mt -60.39 121.81 9.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.308 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 83.4 mt -108.95 140.32 42.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.003 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.528 ' HB ' HG21 ' A' ' 87' ' ' VAL . 2.5 t -134.21 125.41 27.76 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.202 0.525 . . . . 0.0 110.517 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -121.52 141.9 50.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.483 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.465 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.7 p -113.55 132.44 55.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.012 0.434 . . . . 0.0 111.48 -178.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.44 124.34 29.07 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.089 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -77.91 145.0 22.08 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 123.153 2.569 . . . . 0.0 112.267 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.0 147.76 49.72 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 122.453 2.102 . . . . 0.0 111.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.91 155.17 16.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.096 -176.378 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -56.47 -43.97 80.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.555 0.217 . . . . 0.0 111.487 -173.511 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -45.89 92.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.149 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.22 -40.06 95.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.045 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.36 -30.58 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.704 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -71.85 -43.96 64.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.853 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.45 -48.15 61.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.734 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.5 p -80.91 -13.09 59.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.54 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 60.16 21.26 10.56 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.865 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.3 m -137.82 137.75 38.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.349 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.534 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -97.12 148.91 22.56 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.4 p30 -157.73 127.73 6.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.001 0.429 . . . . 0.0 110.484 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.524 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -84.41 146.94 27.39 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.063 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.7 m -124.22 120.97 33.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.169 0.509 . . . . 0.0 111.154 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.576 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.4 t -113.27 137.69 51.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' A' ' 67' ' ' LYS . 1.2 tt -131.9 138.08 48.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.854 0.359 . . . . 0.0 110.629 175.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.622 HG22 ' H ' ' A' ' 66' ' ' ALA . 4.4 m -115.03 147.1 18.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.539 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 7.3 p -143.19 175.25 10.02 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.708 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 59.1 31.99 21.77 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.54 HD23 HG23 ' A' ' 4' ' ' ILE . 49.5 mt -71.34 118.36 14.04 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.863 ' HB2' ' HA3' ' A' ' 2' ' ' GLY . . . -75.37 -49.63 18.44 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.163 0.506 . . . . 0.0 110.573 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 p -84.52 152.36 23.97 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.982 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -110.38 150.69 28.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.433 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.423 ' O ' ' HE1' ' A' ' 89' ' ' HIS . 47.1 mt-10 66.75 164.99 0.2 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.994 0.809 . . . . 0.0 111.863 -178.465 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.4 m 64.5 60.74 0.89 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.463 176.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.692 HD13 ' N ' ' A' ' 38' ' ' ASN . 2.0 tm? -125.16 156.24 38.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 170.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.692 ' N ' HD13 ' A' ' 37' ' ' LEU . 63.5 t30 -149.44 155.39 40.34 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.627 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.644 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.1 mm -120.87 135.23 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 t -138.73 147.46 42.72 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -123.7 149.3 45.67 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.372 177.066 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -147.07 150.93 36.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 m -74.73 150.6 39.38 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 55.1 tp60 -52.59 -24.7 8.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.017 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.6 p -73.5 -6.72 48.23 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.175 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.24 19.92 37.39 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.99 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.4 mt-10 -100.02 121.5 53.74 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 24.3 Cg_exo -63.55 139.6 71.01 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.826 2.351 . . . . 0.0 112.93 -175.612 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.5 mt -107.07 145.43 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.596 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -72.0 106.85 4.44 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.929 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 m -104.11 124.98 50.05 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.44 -176.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 59.0 tttm -122.63 136.76 54.97 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.63 HG12 ' HA2' ' A' ' 68' ' ' GLY . 81.1 mt -110.26 133.78 54.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.257 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.306 -177.952 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -95.65 140.17 30.84 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 174.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t 70.89 105.88 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 O-C-N 124.275 0.984 . . . . 0.0 108.443 -162.162 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -72.41 -0.92 13.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.587 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -124.51 154.3 40.76 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.079 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -77.96 169.04 18.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.367 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 37.8 m-70 -86.51 144.7 38.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.871 -170.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.514 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 11.3 Cg_exo -70.51 144.65 50.62 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.62 2.88 . . . . 0.0 115.622 -163.222 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.677 ' HB3' ' HB2' ' A' ' 64' ' ' PHE . 64.8 t30 152.02 42.64 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.348 1.859 . . . . 0.0 106.351 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.05 -69.0 2.24 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 107.161 -2.376 . . . . 0.0 107.161 -157.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.456 HG22 HD12 ' A' ' 31' ' ' LEU . 32.4 m -154.22 146.17 23.56 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 158.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.677 ' HB2' ' HB3' ' A' ' 61' ' ' ASN . 81.1 t80 -134.86 -31.91 1.0 Allowed 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.969 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 32.7 t -163.16 151.32 13.72 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.963 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.622 ' H ' HG22 ' A' ' 28' ' ' VAL . . . -132.73 155.93 47.96 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.236 170.796 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 27' ' ' LEU . 29.5 mtpp -131.93 140.18 48.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.644 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.95 132.51 5.76 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.354 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 60.9 t -116.53 133.33 63.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.896 0.379 . . . . 0.0 110.525 -177.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.06 139.33 49.96 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.611 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.3 m -97.69 119.0 35.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.005 0.431 . . . . 0.0 110.544 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.534 HG23 ' HB3' ' A' ' 22' ' ' ALA . 11.7 m -130.49 166.53 27.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.859 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.73 150.83 36.23 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.408 HG12 ' ND2' ' A' ' 78' ' ' ASN . 24.2 t -61.0 -32.98 53.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.73 0.776 . . . . 0.0 109.151 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -56.85 -38.81 73.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.94 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.08 -41.08 91.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 -175.436 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -34.31 62.71 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.673 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.408 ' ND2' HG12 ' A' ' 74' ' ' VAL . 69.8 m-20 -69.91 -20.38 63.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.656 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -102.3 8.16 40.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.023 0.439 . . . . 0.0 110.772 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 59.74 38.12 21.82 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.753 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -63.58 164.09 10.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.094 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 42.1 mp0 -107.64 137.17 46.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.602 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 100' ' ' ILE . 60.0 m-85 -129.58 148.24 51.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.875 174.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.609 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 2.6 p -133.19 135.12 57.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.4 p -104.74 142.92 33.85 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.111 0.481 . . . . 0.0 110.808 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -113.96 130.22 56.54 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.732 176.237 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.528 HG21 ' HB ' ' A' ' 6' ' ' THR . 59.0 t -104.64 127.15 59.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.783 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 m -127.47 94.5 4.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.424 0.63 . . . . 0.0 110.726 -173.396 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' C ' ' H ' ' A' ' 91' ' ' ASP . 1.4 t60 -99.54 -10.84 21.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.045 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.89 -6.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.692 0.758 . . . . 0.0 109.552 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 89' ' ' HIS . 19.8 t70 -72.82 -29.43 63.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.32 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -118.57 154.47 52.46 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.319 178.843 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.64 -20.33 17.89 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.118 2.545 . . . . 0.0 112.937 -177.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 52.1 p -132.13 118.57 16.32 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 18.6 Cg_endo -58.22 141.11 96.46 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.749 2.299 . . . . 0.0 111.362 177.79 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.521 ' O ' ' HA ' ' A' ' 86' ' ' THR . 45.4 mt-30 -83.9 149.71 26.18 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.636 -177.094 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 28.3 mtpp -125.74 137.31 53.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 -176.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 71.3 mmtt -129.9 133.96 47.19 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 42.3 m-85 -101.23 124.41 46.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.33 -174.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.529 HG22 ' O ' ' A' ' 83' ' ' PHE . 13.0 tt -122.0 141.3 42.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.896 0.379 . . . . 0.0 111.15 -178.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.505 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 22.8 p -156.86 149.53 23.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.469 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.921 -0.561 . . . . 0.0 109.489 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.2 mmt . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.887 0.375 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.64 178.15 23.48 Favored Glycine 0 N--CA 1.445 -0.735 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.961 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -101.4 122.43 43.73 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.67 0.272 . . . . 0.0 110.643 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.499 HG23 HD23 ' A' ' 31' ' ' LEU . 28.2 mt -62.18 121.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.591 -176.453 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 86.5 mt -115.49 132.83 56.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.831 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.1 t -121.31 130.54 53.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -125.0 146.65 49.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.519 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.1 p -116.41 137.79 51.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.061 0.458 . . . . 0.0 111.12 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.516 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -117.89 126.6 27.18 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.974 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HA ' HD11 ' A' ' 100' ' ' ILE . 96.0 Cg_endo -78.7 148.36 22.69 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 123.048 2.499 . . . . 0.0 112.55 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -77.51 150.16 27.91 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.601 2.201 . . . . 0.0 111.506 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.7 t -88.97 149.14 23.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.512 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.3 -43.31 71.01 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -60.97 -46.26 91.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.421 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.92 -37.15 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.176 -177.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 12' ' ' SER . 71.0 mt -61.46 -36.92 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.079 0.466 . . . . 0.0 110.434 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -72.22 -43.82 63.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.187 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 14' ' ' ALA . 10.8 mp -66.92 -48.45 68.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.235 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -75.51 -12.81 60.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.476 -178.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 70.79 -10.65 0.71 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.298 0.639 . . . . 0.0 111.131 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 19' ' ' SER . 10.0 p -138.72 147.38 42.65 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.233 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.599 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.08 156.78 19.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 31.1 m-80 -139.42 116.84 11.3 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.639 -171.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.593 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.43 144.1 44.43 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 174.587 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.516 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 39.1 m -125.27 124.21 41.16 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.086 0.47 . . . . 0.0 110.415 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 26.2 t -112.1 136.93 50.86 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.818 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -125.08 122.68 37.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 65' ' ' SER . 24.3 t -121.98 126.42 74.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.7 m -139.14 176.39 8.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.383 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 10.0 m120 57.32 50.61 11.23 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.86 0.725 . . . . 0.0 111.242 -179.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD23 HG23 ' A' ' 4' ' ' ILE . 65.2 mt -74.66 149.55 39.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.742 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.84 56.52 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.9 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.454 ' H ' ' HE1' ' A' ' 89' ' ' HIS . 70.3 p -99.1 -164.38 1.12 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -102.56 -25.23 13.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.989 0.423 . . . . 0.0 110.234 178.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -163.51 -174.11 3.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.038 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.671 ' HA ' ' HG3' ' A' ' 57' ' ' GLU . 28.8 m 74.88 109.38 0.07 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.581 0.55 . . . . 0.0 111.441 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 58' ' ' SER . 54.8 tp -166.85 149.84 6.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.695 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 91.1 m-20 -128.29 157.61 40.45 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.303 0.377 . . . . 0.0 110.302 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.657 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.7 mm -122.14 137.63 55.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 t -136.26 143.77 44.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.685 0.279 . . . . 0.0 110.369 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.411 ' CH2' ' HB3' ' A' ' 24' ' ' LEU . 66.7 m95 -129.15 145.82 51.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.981 0.419 . . . . 0.0 110.785 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.78 139.82 17.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.591 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.542 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 29.5 t -66.36 155.26 37.86 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.117 0.484 . . . . 0.0 110.387 174.515 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -62.89 -24.1 67.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.185 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.409 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m -76.67 -3.77 39.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.051 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.83 21.7 38.78 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.755 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 21.5 mt-10 -92.67 121.1 66.8 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 17.1 Cg_exo -66.12 134.23 35.96 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.932 1.755 . . . . 0.0 111.419 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.896 HD12 ' HB1' ' A' ' 70' ' ' ALA . 1.7 mm? -102.68 141.48 35.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.302 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -92.01 107.4 19.18 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.656 176.518 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.0 m -98.69 133.91 42.35 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.832 -174.563 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.489 ' HB2' HG13 ' A' ' 69' ' ' VAL . 47.8 mtmt -94.28 123.17 37.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.579 HD11 ' HB ' ' A' ' 39' ' ' ILE . 30.9 mm -124.94 120.78 59.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.213 -175.038 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.414 ' O ' ' HB ' ' A' ' 55' ' ' VAL . 91.8 mttt -97.29 110.13 22.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.515 HG12 ' H ' ' A' ' 57' ' ' GLU . 86.3 t 73.5 114.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.385 -168.359 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -67.46 8.77 0.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.671 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 33.7 tt0 -132.81 154.81 49.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -176.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.591 ' HB3' ' HB2' ' A' ' 66' ' ' ALA . 22.9 p -76.23 148.57 37.56 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -176.553 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.439 ' HB2' ' HB ' ' A' ' 63' ' ' THR . 14.0 m-70 -92.57 124.89 57.77 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.852 -172.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -107.08 0.61 0.15 Allowed 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.88 3.053 . . . . 0.0 113.93 177.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -97.97 -79.78 0.46 Allowed 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.224 -174.558 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -87.18 6.44 83.33 Favored Glycine 0 CA--C 1.509 -0.287 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.497 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.439 ' HB ' ' HB2' ' A' ' 59' ' ' HIS . 4.9 m -149.5 166.11 30.16 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -124.12 22.63 8.65 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 1.4 m -144.39 162.35 36.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.305 -167.77 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 58' ' ' SER . . . -109.54 149.81 29.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.064 164.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 39.5 mtpt -131.94 141.24 49.26 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.657 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.63 131.66 5.59 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.6 -177.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -122.93 124.13 69.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.989 0.423 . . . . 0.0 110.632 -177.139 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.896 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -116.36 147.38 41.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.351 -176.115 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -104.85 123.64 48.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.988 0.423 . . . . 0.0 111.309 -172.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.607 HG12 HD11 ' A' ' 49' ' ' LEU . 6.4 m -125.38 164.4 24.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.281 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.4 t -82.21 153.72 25.8 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.47 -33.75 52.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.154 0.502 . . . . 0.0 110.256 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 7.8 mm-40 -59.93 -33.34 71.76 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.863 -179.191 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 15.6 m-20 -64.55 -42.43 95.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.436 0.636 . . . . 0.0 109.387 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.0 OUTLIER -74.03 -35.44 64.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.546 179.071 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 69.3 m-20 -64.23 -33.42 75.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.341 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -90.72 8.23 35.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.112 0.482 . . . . 0.0 110.663 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 54.5 38.28 29.42 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.345 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 57.3 mtpt -66.36 159.81 26.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.751 175.763 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -118.08 141.22 48.71 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.972 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 96.6 m-85 -120.04 151.57 38.81 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.224 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.9 t -121.42 129.41 75.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.583 -173.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.618 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 45.1 t -105.77 122.39 46.0 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.496 -0.482 . . . . 0.0 109.714 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.8 112.2 25.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.185 0.517 . . . . 0.0 110.701 176.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.43 ' HB ' ' CG ' ' A' ' 96' ' ' GLN . 43.2 t -97.53 125.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.126 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.5 m -118.46 112.81 20.44 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.619 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 7.3 t-160 -97.98 -50.4 4.42 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.058 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 42.4 ttm180 144.89 -33.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 O-C-N 125.396 1.685 . . . . 0.0 109.947 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.479 ' OD1' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -72.04 -35.19 69.27 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.959 -168.941 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.64 146.05 32.39 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 121.426 0.631 . . . . 0.0 111.301 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.14 -19.24 26.42 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 123.54 2.827 . . . . 0.0 112.466 -174.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 24.0 t -144.13 135.54 12.69 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.74 141.4 95.61 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.047 2.498 . . . . 0.0 112.396 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.43 ' CG ' ' HB ' ' A' ' 87' ' ' VAL . 3.5 pt20 -81.42 133.25 35.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.818 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.3 ptpt -114.82 142.71 46.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.304 0.574 . . . . 0.0 111.707 -175.292 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 32.7 mmtm -129.73 140.0 51.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.232 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CD1' HG22 ' A' ' 84' ' ' VAL . 79.3 m-85 -101.36 133.45 45.94 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.035 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.4 tt -128.68 136.3 60.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.996 0.426 . . . . 0.0 111.182 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.3 p -158.74 146.72 18.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.074 176.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.633 -176.484 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 tmm? . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.81 152.58 19.76 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.6 119.03 9.73 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.824 0.312 . . . . 0.0 110.225 -178.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.762 HD12 ' N ' ' A' ' 36' ' ' THR . 68.1 mt -60.37 129.08 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 169.182 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.3 mt -104.1 128.82 51.76 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.156 -171.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.412 HG23 ' HD3' ' A' ' 98' ' ' LYS . 4.1 t -120.3 129.31 53.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.717 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -131.13 141.98 50.19 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.738 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 p -113.08 133.63 54.91 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.848 176.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.3 mp -116.58 124.8 29.01 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.051 -175.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.507 ' HA ' HD11 ' A' ' 100' ' ' ILE . 52.5 Cg_endo -69.57 139.1 40.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.694 2.262 . . . . 0.0 111.687 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 55.7 Cg_endo -65.82 144.17 76.35 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.886 2.39 . . . . 0.0 111.837 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.1 m -85.64 148.59 25.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.641 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -54.71 -42.38 71.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.727 0.24 . . . . 0.0 111.275 -173.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -57.81 -45.1 86.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.325 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.83 -42.19 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.85 0.357 . . . . 0.0 110.817 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 21' ' ' SER . 62.1 mt -66.15 -38.82 82.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.661 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -74.03 -43.25 58.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.12 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -64.25 -47.7 78.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.727 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 78.6 p -85.98 -12.31 50.71 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.233 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 32.7 mmtp 65.47 17.43 10.95 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.742 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 23.1 m -139.13 147.21 41.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.394 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -92.04 136.72 32.95 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 88.5 m-20 -114.17 122.95 48.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.635 -173.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 83.4 mt -85.3 125.4 32.89 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.668 177.376 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.9 m -113.64 123.98 51.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.314 0.578 . . . . 0.0 111.434 -176.077 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.546 ' HB3' HD12 ' A' ' 39' ' ' ILE . 18.2 t -124.38 137.05 54.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.656 176.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.51 124.22 26.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.527 ' HB ' HD12 ' A' ' 37' ' ' LEU . 12.1 t -119.2 129.92 74.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.5 p -143.19 177.37 8.45 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.228 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 15.2 m120 62.53 50.33 3.64 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.706 0.765 . . . . 0.0 109.772 174.322 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.713 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -74.56 65.9 1.34 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.869 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -83.31 -2.75 56.45 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.641 -1.618 . . . . 0.0 109.883 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.542 ' HA ' HD11 ' A' ' 4' ' ' ILE . 80.6 p 72.14 101.35 0.07 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.125 175.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.531 ' O ' HD23 ' A' ' 92' ' ' LEU . 58.1 t80 173.36 -21.07 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.725 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.732 ' HA ' ' CD2' ' A' ' 92' ' ' LEU . 5.6 mm-40 -144.02 38.26 1.31 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.958 ' HB ' ' CD1' ' A' ' 92' ' ' LEU . 15.1 t 48.4 155.34 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 169.451 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.999 ' H ' ' HB2' ' A' ' 89' ' ' HIS . 0.6 OUTLIER -150.71 149.3 29.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.911 175.538 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.67 ' N ' ' HB ' ' A' ' 87' ' ' VAL . 63.7 t30 163.45 175.55 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 166.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.613 ' HB ' HD11 ' A' ' 53' ' ' ILE . 14.7 mm -122.9 130.47 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 C-N-CA 118.77 -1.172 . . . . 0.0 109.794 169.4 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.8 t -155.53 121.88 5.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.418 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 78.0 m95 -103.04 142.27 34.39 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.447 0.641 . . . . 0.0 111.663 -174.052 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.05 164.97 36.11 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.116 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.48 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 86.9 p -82.17 168.39 17.74 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 177.685 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -63.7 -22.82 67.1 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.292 0.567 . . . . 0.0 110.259 174.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -87.43 -5.49 58.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.222 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.36 22.37 29.59 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.793 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 6.5 pt-20 -93.09 133.14 29.21 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 117.449 0.624 . . . . 0.0 109.433 176.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 16.3 Cg_exo -67.8 136.52 38.98 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.689 2.259 . . . . 0.0 112.306 -177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.436 HD23 ' HA ' ' A' ' 49' ' ' LEU . 11.2 mt -109.02 140.83 42.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.785 178.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.35 107.22 0.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.475 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 7.8 m -131.09 126.29 35.39 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.745 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -103.45 123.06 46.16 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.326 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.613 HD11 ' HB ' ' A' ' 39' ' ' ILE . 49.6 mm -124.5 131.31 72.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.619 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -101.8 108.47 19.97 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.247 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.729 HG12 ' H ' ' A' ' 57' ' ' GLU . 47.4 t 72.35 120.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 O-C-N 124.213 0.946 . . . . 0.0 110.425 -173.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 83.7 mtp -79.26 10.26 3.84 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.268 0.556 . . . . 0.0 111.269 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.729 ' H ' HG12 ' A' ' 55' ' ' VAL . 37.6 mt-10 -121.96 156.04 34.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.459 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 34.0 t -77.11 157.16 31.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.329 -172.266 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -103.85 124.58 37.25 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -108.84 13.68 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 123.69 2.927 . . . . 0.0 113.344 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -93.25 -84.68 0.29 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.124 -176.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.79 2.17 79.51 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.43 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 m -142.99 169.3 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -129.77 23.4 5.38 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.036 0.445 . . . . 0.0 110.347 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 m -154.49 168.67 25.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 112.193 -172.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.26 135.35 50.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.076 168.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -131.14 138.88 49.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.575 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -144.89 141.22 9.77 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 48.0 t -123.67 133.74 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.629 0.252 . . . . 0.0 110.739 -174.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.495 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -116.15 142.61 46.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 p -100.0 115.46 29.75 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.956 0.408 . . . . 0.0 111.175 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.554 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.9 m -119.44 166.47 13.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.867 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.1 t -81.02 151.89 28.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.24 -24.99 36.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.86 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.71 -34.76 77.52 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.987 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.41 -49.75 76.58 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.453 0.644 . . . . 0.0 109.778 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.579 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -67.78 -34.26 76.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.753 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -68.97 -30.37 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.26 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -92.93 8.58 39.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.325 . . . . 0.0 110.602 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 59.89 36.76 21.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.475 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -63.41 154.67 31.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.298 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 100' ' ' ILE . 25.6 tt0 -118.27 139.31 51.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.558 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 87.5 m-85 -122.64 162.85 21.13 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.49 -176.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.582 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.7 t -131.35 126.35 58.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.984 -175.684 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 45.9 t -111.44 123.51 50.36 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -110.68 125.62 53.65 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.67 ' HB ' ' N ' ' A' ' 38' ' ' ASN . 1.6 m -107.23 145.63 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.152 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.233 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.469 ' H ' ' HB3' ' A' ' 38' ' ' ASN . 2.6 p -143.45 81.2 1.7 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.521 0.676 . . . . 0.0 112.537 -164.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.999 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 6.2 t-80 -82.63 -9.15 59.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.54 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.14 21.07 12.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -170.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 t70 -84.46 -33.48 23.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.369 -177.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.958 ' CD1' ' HB ' ' A' ' 36' ' ' THR . 0.3 OUTLIER -136.53 163.11 52.19 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.167 -179.399 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.23 -31.13 14.89 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.51 2.14 . . . . 0.0 112.651 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.467 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 3.9 p -109.5 102.49 49.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.474 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.467 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 37.9 Cg_endo -64.11 152.38 81.31 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 123.198 2.599 . . . . 0.0 111.666 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.621 ' NE2' ' HB3' ' A' ' 35' ' ' GLU . 35.6 mt-30 -95.82 130.51 42.73 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.052 -175.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -105.78 132.85 51.41 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.893 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.582 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 3.5 mmmp? -114.52 137.51 51.76 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.544 -178.634 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -101.28 138.85 37.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.811 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.507 HD11 ' HA ' ' A' ' 10' ' ' PRO . 11.4 tt -144.24 137.64 23.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 p -157.51 149.56 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.838 0.351 . . . . 0.0 111.347 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 21.5 tptm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.028 177.526 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mmt . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.23 51.61 13.11 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 124.83 27.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.556 -0.822 . . . . 0.0 110.836 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.416 HG23 ' CD1' ' A' ' 31' ' ' LEU . 69.4 mt -66.97 122.26 17.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.681 -174.291 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -105.62 135.3 47.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.395 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.509 HG23 ' HE2' ' A' ' 98' ' ' LYS . 4.3 t -125.9 130.16 50.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.271 0.558 . . . . 0.0 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -126.6 136.41 52.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.808 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 p -113.75 132.18 55.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.035 0.445 . . . . 0.0 111.391 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -119.21 126.0 27.29 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.203 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.84 145.79 36.85 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.844 2.362 . . . . 0.0 111.815 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -64.21 151.54 84.96 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.5 2.134 . . . . 0.0 111.928 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 p -97.33 151.6 19.75 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.817 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -54.04 -43.45 70.19 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.692 0.282 . . . . 0.0 111.489 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.456 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.09 -46.35 84.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.125 -178.223 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -64.66 -41.24 96.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.059 -176.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.75 -36.61 76.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.709 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.45 -45.39 54.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.051 0.453 . . . . 0.0 111.099 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.5 mm? -67.24 -48.28 68.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -74.01 -20.25 60.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.13 0.49 . . . . 0.0 110.888 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 64.44 11.03 6.21 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.917 0.865 . . . . 0.0 110.301 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 m -138.78 141.56 38.79 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.268 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.545 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -86.92 155.4 20.23 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.3 p30 -158.17 129.15 6.42 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.867 0.365 . . . . 0.0 110.738 -173.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -87.1 142.99 27.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.02 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.9 m -122.31 116.98 25.02 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.639 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.5 t -111.42 131.56 55.1 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.742 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.2 tt -121.44 128.89 52.6 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.17 0.509 . . . . 0.0 109.879 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.82 ' HB ' HD21 ' A' ' 37' ' ' LEU . 33.3 t -121.51 132.33 70.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.656 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -142.5 175.95 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.895 0.379 . . . . 0.0 111.235 -172.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.7 m120 63.48 46.98 4.03 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.414 175.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.595 HD22 ' H ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -85.94 150.73 24.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.088 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.25 -47.26 16.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.319 0.58 . . . . 0.0 109.465 176.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.0 p -101.37 92.3 4.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.466 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -46.78 -73.81 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.926 -166.306 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -84.23 55.41 3.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.221 0.534 . . . . 0.0 111.391 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 m -145.26 36.99 1.12 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 122.047 0.927 . . . . 0.0 109.03 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.82 HD21 ' HB ' ' A' ' 28' ' ' VAL . 50.5 tp -108.44 153.16 23.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.137 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -135.77 148.67 48.87 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.718 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.2 mm -121.56 137.44 55.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.6 t -146.45 144.6 29.79 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.693 0.283 . . . . 0.0 110.741 -179.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 64.5 m95 -125.19 156.75 37.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.139 0.495 . . . . 0.0 111.443 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.39 155.1 29.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.505 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.3 m -80.04 157.54 26.72 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -53.51 -25.14 15.38 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.082 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.0 p -78.66 -2.15 37.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.55 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.47 22.06 48.89 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.776 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 42.6 mt-10 -99.55 123.82 46.69 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 25.1 Cg_exo -61.07 136.24 63.98 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.482 2.121 . . . . 0.0 112.097 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.1 mt -101.8 146.29 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.137 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -68.17 105.74 2.19 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 175.448 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.439 HG22 HD11 ' A' ' 53' ' ' ILE . 6.3 m -118.14 114.38 22.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.524 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -114.93 122.03 45.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.152 0.501 . . . . 0.0 109.977 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.439 HD11 HG22 ' A' ' 51' ' ' THR . 4.7 mp -120.58 138.47 50.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.127 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -94.57 121.86 36.56 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.506 HG12 ' H ' ' A' ' 57' ' ' GLU . 22.3 t 65.37 103.06 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 O-C-N 124.279 0.987 . . . . 0.0 108.964 -162.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 40.8 tpp -74.15 12.75 0.66 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.849 0.833 . . . . 0.0 110.568 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.506 ' H ' HG12 ' A' ' 55' ' ' VAL . 27.6 mt-10 -120.72 157.24 30.08 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.069 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -74.97 150.93 38.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.116 0.484 . . . . 0.0 111.24 -167.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.632 ' HB3' ' OD1' ' A' ' 61' ' ' ASN . 73.4 m-70 -104.72 134.54 19.6 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.218 -167.381 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.515 ' HA ' ' O ' ' A' ' 63' ' ' THR . 97.5 Cg_endo -98.34 15.26 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.525 2.817 . . . . 0.0 112.708 175.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.632 ' OD1' ' HB3' ' A' ' 59' ' ' HIS . 27.8 p-10 -89.96 80.64 6.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.761 0.791 . . . . 0.0 111.234 -175.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.49 1.74 87.63 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.728 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.515 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 7.8 t -153.28 172.89 16.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -125.45 23.44 7.51 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.427 ' H ' HG23 ' A' ' 63' ' ' THR . 1.4 m -126.13 172.26 10.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.936 -167.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -110.3 148.78 31.26 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 18.5 ptpt -132.64 141.22 48.54 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.339 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.718 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.27 128.95 6.12 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.781 178.284 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.9 t -109.83 127.04 66.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.908 0.385 . . . . 0.0 110.285 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.605 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.13 130.28 56.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.33 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.0 p -97.37 114.55 26.38 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.288 0.566 . . . . 0.0 111.007 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.545 HG23 ' HB3' ' A' ' 22' ' ' ALA . 17.9 m -119.8 167.15 13.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.083 -176.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.4 m -74.69 146.64 42.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.6 t -58.98 -33.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.45 0.643 . . . . 0.0 109.63 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.64 -33.57 71.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.722 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -63.5 -44.23 94.92 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.362 0.601 . . . . 0.0 109.653 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.466 ' NE1' ' HD3' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -74.29 -34.13 63.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.522 179.501 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -66.99 -25.16 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -95.35 7.38 46.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.703 177.912 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 54.49 37.79 28.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.5 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -63.97 158.46 22.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.137 0.494 . . . . 0.0 111.144 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 35.0 tt0 -109.32 139.53 44.15 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.632 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -123.07 156.83 34.11 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.095 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.425 HG22 ' CD1' ' A' ' 99' ' ' PHE . 98.7 t -125.54 126.04 69.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.489 -175.145 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.838 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.3 p -105.48 142.84 34.54 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -123.26 124.22 42.5 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.194 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.8 t -93.73 125.55 46.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 p -119.66 87.11 2.68 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.564 0.697 . . . . 0.0 111.061 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' HB3' ' A' ' 31' ' ' LEU . 10.1 t60 -98.42 -11.55 22.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.311 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.549 ' HD3' ' O ' ' A' ' 90' ' ' ARG . 0.6 OUTLIER 71.14 -20.75 0.21 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.508 0.723 . . . . 0.0 111.28 -178.669 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.463 ' H ' ' C ' ' A' ' 89' ' ' HIS . 25.0 t70 -72.35 -36.29 68.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.987 0.422 . . . . 0.0 110.431 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.36 150.71 61.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.428 177.082 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 -20.15 15.23 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.93 2.42 . . . . 0.0 112.508 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 57.3 p -145.46 130.52 9.14 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.447 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 15.4 Cg_endo -57.35 140.73 93.93 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.512 2.141 . . . . 0.0 111.561 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' THR . 46.9 mt-30 -86.9 132.91 33.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -107.93 135.83 48.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.575 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.838 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 65.9 mmtt -126.54 135.74 51.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.885 174.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' CD1' HG22 ' A' ' 84' ' ' VAL . 61.5 m-85 -101.46 129.97 47.61 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.734 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 13.9 tt -128.51 138.99 53.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.668 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.5 t -154.85 149.98 26.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.466 ' HD3' ' NE1' ' A' ' 77' ' ' TRP . 22.8 tptm . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.931 -177.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.482 1.147 0 CA-C-O 120.598 0.237 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -170.47 107.4 0.26 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.636 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 69.31 127.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 121.605 0.717 . . . . 0.0 111.304 -175.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.481 HG23 HD23 ' A' ' 31' ' ' LEU . 77.8 mt -68.93 122.76 20.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.974 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.0 mt -104.44 130.14 52.36 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.497 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 2.4 t -127.93 130.31 48.26 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.197 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -128.44 146.34 50.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.005 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.4 p -112.64 135.01 53.87 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.27 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.96 122.25 31.6 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.004 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.48 141.35 50.58 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.999 2.466 . . . . 0.0 111.967 177.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.543 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.4 Cg_endo -67.87 150.19 78.35 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.605 2.203 . . . . 0.0 111.424 177.538 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.0 t -78.88 131.23 36.35 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.71 -177.03 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.602 ' HB2' ' HE3' ' A' ' 102' ' ' LYS . 61.6 t80 -58.83 -34.01 71.06 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.114 -174.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.65 76.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.337 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.86 -38.08 87.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.055 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 ' HG2' ' A' ' 11' ' ' PRO . 75.1 mt -62.08 -36.82 76.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.355 176.275 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -72.38 -44.31 62.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.568 -178.002 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.4 mp -71.02 -48.28 53.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.586 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.3 m -79.67 -16.18 56.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.871 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 60.7 19.85 9.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.903 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.6 m -139.87 129.94 25.0 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.49 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -90.43 154.83 19.37 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -160.13 130.31 5.42 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.859 0.361 . . . . 0.0 110.733 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -84.22 138.29 33.04 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.992 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.4 m -120.62 127.04 51.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 -178.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.517 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 46.5 t -114.53 138.0 51.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.011 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -122.59 123.11 40.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 65' ' ' SER . 46.6 t -120.96 127.05 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.078 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.5 t -143.69 178.8 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.75 0.309 . . . . 0.0 111.235 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 60.02 33.58 21.36 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.314 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.681 HD11 HD22 ' A' ' 37' ' ' LEU . 56.3 mt -57.11 142.28 43.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.728 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.27 -50.11 13.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.432 178.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.51 HG22 ' OD2' ' A' ' 91' ' ' ASP . 15.1 t -107.74 168.06 9.53 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.265 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -108.94 8.81 26.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.885 0.374 . . . . 0.0 110.286 -178.003 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -76.53 91.33 3.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.462 -173.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.0 m 59.68 102.1 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 169.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.681 HD22 HD11 ' A' ' 31' ' ' LEU . 51.0 tp -103.21 145.42 29.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.74 -0.6 . . . . 0.0 110.173 174.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -134.05 150.49 51.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.925 -178.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.687 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.1 mm -121.25 136.69 57.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.5 t -138.99 153.19 48.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.517 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 73.9 m95 -134.51 146.99 50.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.383 0.611 . . . . 0.0 111.798 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.47 165.72 34.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.702 -1.136 . . . . 0.0 107.969 176.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.538 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 63.1 p -88.13 173.32 8.9 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.955 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 82' ' ' GLU . 6.0 tp-100 -58.77 -34.97 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.401 0.62 . . . . 0.0 110.062 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.9 m -78.55 -5.7 53.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.806 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 11.71 59.38 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.225 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.538 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 7.1 pt-20 -76.38 131.75 74.22 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -178.498 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -64.43 138.28 59.4 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.282 1.988 . . . . 0.0 112.012 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 49' ' ' LEU . 8.9 mt -120.16 136.07 54.75 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.463 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.92 107.58 7.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.233 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.9 m -93.97 132.22 38.64 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.525 -177.82 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.532 ' HB2' HG13 ' A' ' 69' ' ' VAL . 43.5 mttm -97.34 122.72 40.69 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 176.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.45 HD11 ' HB ' ' A' ' 39' ' ' ILE . 78.9 mt -129.56 118.58 45.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.729 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -129.88 126.58 38.3 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.342 -0.844 . . . . 0.0 108.928 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.9 m -76.56 47.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.0 ttm -64.41 -33.68 76.43 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 170.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -151.52 132.6 14.35 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.02 169.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.8 p -126.05 140.89 52.23 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 169.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.75 ' HB3' ' HD2' ' A' ' 60' ' ' PRO . 28.4 m80 -89.52 161.6 39.01 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.72 -171.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.75 ' HD2' ' HB3' ' A' ' 59' ' ' HIS . 30.6 Cg_exo -13.18 138.24 0.0 OUTLIER 'Trans proline' 0 C--N 1.367 1.513 1 C-N-CA 127.988 5.792 . . . . 0.0 118.526 -166.565 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.7 m120 70.26 -160.8 0.15 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.986 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -52.01 -54.29 26.54 Favored Glycine 0 CA--C 1.505 -0.55 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 37' ' ' LEU . 11.2 m -153.03 146.08 24.6 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 163.053 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -133.02 -30.3 1.37 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.707 ' HB2' ' HB2' ' A' ' 59' ' ' HIS . 11.1 m -145.01 150.83 37.58 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.674 173.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.443 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -141.49 162.43 35.51 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.065 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -130.27 140.75 50.66 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.687 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.39 127.62 3.87 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.603 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -124.97 133.27 69.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.09 0.472 . . . . 0.0 111.065 -173.512 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.73 134.51 55.04 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.663 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -96.77 119.11 34.64 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.126 0.489 . . . . 0.0 110.327 -174.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' A' ' 22' ' ' ALA . 20.0 m -126.35 166.28 22.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.269 -175.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.9 t -75.02 154.65 37.93 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.2 t -61.2 -33.47 56.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 13.2 mm-40 -62.57 -30.8 71.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.748 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.68 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 6.4 m-20 -59.7 -50.99 71.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.171 0.51 . . . . 0.0 109.652 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -63.11 -37.15 86.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.007 176.862 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 90.6 m-20 -69.49 -18.89 63.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.857 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -94.27 7.06 46.71 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.12 -0.363 . . . . 0.0 111.02 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 57.78 27.36 14.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.874 0.845 . . . . 0.0 109.525 -174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 76' ' ' ASP . 1.3 tppp? -68.5 142.64 55.23 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.188 -1.369 . . . . 0.0 109.963 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 58.1 mt-10 -105.99 143.93 33.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.929 0.395 . . . . 0.0 110.074 -178.431 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.496 ' HA ' ' HA ' ' A' ' 43' ' ' SER . 71.3 m-85 -121.62 154.86 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.839 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 67.1 t -127.68 133.76 66.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.18 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 39.9 t -105.28 132.65 51.21 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.2 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.49 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -114.87 119.7 37.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.331 176.913 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.99 126.91 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.967 -178.282 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.27 98.48 5.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.645 0.736 . . . . 0.0 110.907 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -99.36 -10.51 22.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.161 -177.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.44 ' HD2' ' O ' ' A' ' 90' ' ' ARG . 1.6 tmm_? 69.91 7.12 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 122.122 0.963 . . . . 0.0 108.85 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.51 ' OD2' HG22 ' A' ' 33' ' ' THR . 13.0 t70 -84.23 -33.73 24.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.287 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.73 152.56 65.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.073 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.85 -23.86 16.02 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.061 2.508 . . . . 0.0 112.961 -175.548 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.5 t -131.17 124.45 20.43 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 110.109 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.8 Cg_endo -60.53 142.51 98.15 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 123.498 2.798 . . . . 0.0 112.848 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -81.99 141.41 33.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.908 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.49 ' HG2' HG23 ' A' ' 86' ' ' THR . 30.6 mtpp -112.11 127.03 55.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 0.0 110.549 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.659 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 71.9 mmtt -117.64 140.05 50.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.51 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.428 ' CD1' HG22 ' A' ' 84' ' ' VAL . 72.8 m-85 -101.59 131.73 47.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.3 tt -121.94 138.14 53.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.249 0.547 . . . . 0.0 111.336 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.1 t -159.06 150.69 20.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.096 176.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.602 ' HE3' ' HB2' ' A' ' 13' ' ' PHE . 42.7 tttm . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.684 176.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.9 ptp . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.9 -91.18 0.89 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.262 -175.312 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 63.52 117.35 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.282 0.633 . . . . 0.0 110.693 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.738 HD12 ' HB3' ' A' ' 92' ' ' LEU . 44.9 mt -59.69 121.21 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.993 0.425 . . . . 0.0 111.155 -172.495 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.2 mt -117.53 132.18 56.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.322 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.32 127.3 53.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.815 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -115.96 130.39 56.8 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.554 ' HB ' HD12 ' A' ' 100' ' ' ILE . 11.2 p -115.9 136.46 53.02 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.014 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -116.54 119.21 36.28 Favored Pre-proline 0 N--CA 1.442 -0.844 0 CA-C-O 121.069 0.461 . . . . 0.0 110.042 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 61.1 Cg_endo -71.59 138.98 33.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.554 2.169 . . . . 0.0 111.065 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.429 ' HD2' ' CE2' ' A' ' 77' ' ' TRP . 54.6 Cg_endo -66.97 151.8 81.46 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.593 2.195 . . . . 0.0 111.711 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 16' ' ' ILE . 20.7 t -82.01 137.42 35.1 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.523 ' HA ' HD12 ' A' ' 16' ' ' ILE . 24.4 t80 -57.88 -30.48 65.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.911 -174.812 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -69.09 -46.07 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.565 176.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.55 -39.81 94.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.497 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 13' ' ' PHE . 72.1 mt -59.48 -37.51 70.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.577 176.157 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -68.72 -42.39 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.361 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.2 mt -61.92 -40.15 94.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.811 -177.609 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.443 ' C ' ' H ' ' A' ' 21' ' ' SER . 25.9 t -88.3 -13.71 40.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.051 -179.206 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' SER . 86.0 tttt 70.88 -8.47 0.95 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.711 0.767 . . . . 0.0 110.618 -174.102 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 19' ' ' SER . 20.0 m -132.41 144.57 50.6 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.268 -178.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.836 ' HB3' ' HB ' ' A' ' 72' ' ' VAL . . . -78.54 175.42 10.37 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.556 ' HA ' HG23 ' A' ' 72' ' ' VAL . 9.9 p30 -160.12 138.05 9.93 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -177.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 31.9 mt -105.97 125.65 51.24 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.01 -176.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.3 m -109.0 127.32 53.98 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.999 0.428 . . . . 0.0 110.54 -177.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.62 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.4 t -118.26 137.13 53.25 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.976 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.15 122.68 32.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.528 ' HB ' HD21 ' A' ' 37' ' ' LEU . 39.2 t -116.08 128.37 73.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.0 p -142.26 177.31 8.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.78 0.324 . . . . 0.0 111.365 -174.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 59.79 38.36 21.53 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.723 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 37' ' ' LEU . 69.8 mt -66.49 131.65 46.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.759 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . -69.45 -49.85 51.11 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.579 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.686 HG22 ' HB2' ' A' ' 91' ' ' ASP . 2.7 t -100.29 157.33 16.68 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 172.036 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.448 ' O ' ' HA3' ' A' ' 62' ' ' GLY . 56.2 m-85 -102.57 34.11 2.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.178 0.513 . . . . 0.0 110.922 -174.091 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.587 ' H ' HG23 ' A' ' 33' ' ' THR . 10.6 tp10 -74.91 167.96 20.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.608 175.299 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 m -54.1 141.35 29.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.205 0.526 . . . . 0.0 111.062 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.793 HD22 HD11 ' A' ' 31' ' ' LEU . 35.8 tp -114.03 151.97 31.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.2 178.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -137.0 153.63 50.62 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.614 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -121.05 136.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.1 t -135.48 135.78 40.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.721 0.296 . . . . 0.0 110.271 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.62 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 68.8 m95 -123.24 139.0 54.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.093 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.77 160.14 42.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.741 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.406 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 79.0 p -87.65 161.53 17.63 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.18 176.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.68 -21.42 66.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.059 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.4 p -76.46 -8.46 57.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.811 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.67 22.44 31.16 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.767 -0.73 . . . . 0.0 113.036 176.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -94.47 121.96 62.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.26 135.3 53.42 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.055 1.836 . . . . 0.0 110.516 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.2 mt -108.31 139.79 42.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.367 0.604 . . . . 0.0 111.885 -171.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 3.6 tm-20 -57.22 116.51 3.32 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.386 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 m -121.75 128.08 51.36 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 -175.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -110.19 136.08 49.96 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.493 HD11 ' HB ' ' A' ' 39' ' ' ILE . 97.8 mt -129.99 118.73 45.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.069 0.461 . . . . 0.0 109.978 176.756 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -129.67 110.21 11.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.294 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.0 p -91.25 87.18 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.838 0.827 . . . . 0.0 111.661 -174.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 88.4 mmm -85.91 -33.6 21.16 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 168.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -142.86 130.91 21.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.615 174.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.3 p -134.3 166.62 22.38 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.432 178.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.729 ' HB3' ' HB3' ' A' ' 64' ' ' PHE . 20.0 m80 -96.68 131.19 28.62 Favored Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 119.391 -0.923 . . . . 0.0 109.346 167.455 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.513 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 93.1 Cg_endo -87.35 -134.01 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.129 2.553 . . . . 0.0 115.602 -164.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 60' ' ' PRO . 13.2 m120 73.23 -79.01 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.919 0.888 . . . . 0.0 109.169 -164.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 34' ' ' TYR . . . -133.89 -59.27 0.07 OUTLIER Glycine 0 CA--C 1.498 -1.003 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 166.463 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.64 HG21 ' HB3' ' A' ' 37' ' ' LEU . 5.3 m -149.28 147.42 28.35 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.448 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.729 ' HB3' ' HB3' ' A' ' 59' ' ' HIS . 63.6 t80 -133.37 -28.76 1.45 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.486 0.66 . . . . 0.0 109.361 175.417 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 19.3 m -149.48 151.06 33.31 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.86 174.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -143.03 163.92 31.49 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.73 -172.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -127.89 137.99 52.51 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 176.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.614 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -147.02 131.57 4.01 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.702 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.5 p -129.42 137.93 55.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.68 0.276 . . . . 0.0 110.899 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.5 151.48 33.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.5 -177.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 26.3 m -98.0 114.16 26.21 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 122.38 1.086 . . . . 0.0 110.89 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.836 ' HB ' ' HB3' ' A' ' 22' ' ' ALA . 1.7 t -116.93 167.83 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.526 -172.913 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.414 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 19.0 m -100.13 139.97 35.03 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 175.422 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 1.9 p -54.32 -36.61 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-O 121.174 0.512 . . . . 0.0 110.475 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -56.41 -36.55 69.06 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.888 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.565 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 44.3 m-20 -67.26 -48.84 66.52 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.297 0.57 . . . . 0.0 109.938 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.429 ' CE2' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -69.12 -34.56 75.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.264 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 11.5 t-20 -66.14 -22.03 66.36 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.241 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -102.12 10.66 39.29 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.128 177.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 80' ' ' ARG . 13.4 mmt180 58.78 36.71 24.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.306 178.791 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.565 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 61.9 mtpt -74.26 164.25 26.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.991 0.424 . . . . 0.0 110.753 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.82 148.98 42.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.812 -176.076 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 93.7 m-85 -130.64 162.06 30.22 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.222 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.4 t -119.58 129.51 75.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.333 0.587 . . . . 0.0 110.953 -177.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 37.7 t -105.45 140.31 38.74 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 173.108 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 m -126.2 132.79 51.7 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.7 t -112.6 125.69 69.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.092 0.472 . . . . 0.0 111.08 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -107.6 85.76 2.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.616 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.509 ' HB3' HD22 ' A' ' 92' ' ' LEU . 3.5 t60 -98.8 -16.84 18.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.898 -176.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 70.89 -22.09 0.19 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.102 0.561 . . . . 0.0 111.408 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.686 ' HB2' HG22 ' A' ' 33' ' ' THR . 14.5 t0 -72.26 -37.04 69.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.661 0.743 . . . . 0.0 110.767 -178.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 4' ' ' ILE . 1.4 pt? -89.55 147.66 38.42 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.057 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -50.41 -32.91 35.75 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.506 2.137 . . . . 0.0 112.717 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 31.5 m -155.93 154.8 28.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -51.74 139.44 48.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.463 2.108 . . . . 0.0 112.062 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.8 pt20 -94.85 141.89 28.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.453 -177.85 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -107.73 127.59 53.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.138 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -120.23 132.89 55.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.624 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.36 135.72 41.36 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -177.581 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' A' ' 8' ' ' THR . 11.9 tt -126.6 137.45 57.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.8 p -158.61 149.55 20.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.248 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.008 179.463 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.538 ' O ' ' HB2' ' A' ' 32' ' ' ALA . . . 90.92 16.13 55.0 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.295 -175.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.19 128.95 34.67 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.802 0.441 . . . . 0.0 110.701 -178.647 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.466 HG23 HD23 ' A' ' 31' ' ' LEU . 64.9 mt -60.2 123.68 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.688 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 65.7 mt -111.78 131.49 55.29 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.053 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.2 t -117.42 130.58 56.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.588 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.9 135.4 51.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.335 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -113.36 132.78 55.47 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.836 0.35 . . . . 0.0 110.754 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -117.62 124.25 29.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.653 -174.792 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.41 139.45 49.52 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.692 2.262 . . . . 0.0 111.583 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.402 ' HG2' HD11 ' A' ' 16' ' ' ILE . 48.9 Cg_endo -67.18 156.09 67.81 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.993 2.462 . . . . 0.0 112.741 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 16' ' ' ILE . 43.9 t -84.17 137.56 33.45 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.493 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -61.37 -42.42 98.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.469 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.96 -35.58 81.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.984 0.421 . . . . 0.0 110.444 177.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -68.02 -44.25 76.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.326 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 12' ' ' SER . 81.1 mt -59.75 -36.8 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.627 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -72.3 -44.09 63.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.517 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.92 -48.07 75.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.504 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 t -75.15 -21.41 58.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttm 69.4 7.05 6.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.695 0.759 . . . . 0.0 110.309 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.5 t -138.49 142.1 39.39 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.501 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.8 144.38 26.27 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.561 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -130.39 120.36 24.15 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.495 0.664 . . . . 0.0 110.821 -174.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.8 mt -78.1 129.72 35.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.233 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.2 m -116.24 126.17 53.24 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.283 0.563 . . . . 0.0 111.107 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.0 t -127.17 137.0 52.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.149 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.13 137.05 48.86 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.642 177.045 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.962 HG21 HD21 ' A' ' 37' ' ' LEU . 11.8 m -117.65 145.3 23.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -142.36 176.43 9.0 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 58.32 48.77 11.99 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.544 0.527 . . . . 0.0 112.068 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.466 HD23 HG23 ' A' ' 4' ' ' ILE . 26.2 mt -82.11 117.03 21.96 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 2' ' ' GLY . . . -59.19 -43.38 92.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.399 0.619 . . . . 0.0 110.685 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 t -105.16 145.13 31.0 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.242 172.612 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -113.09 45.57 1.35 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.285 0.564 . . . . 0.0 110.97 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -92.09 -160.31 0.73 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.266 173.251 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -52.06 126.23 17.89 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.591 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.962 HD21 HG21 ' A' ' 28' ' ' VAL . 34.0 tp -126.27 149.44 49.1 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.61 174.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.424 ' H ' HD12 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -135.03 150.38 50.29 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.976 -177.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.572 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.8 mm -120.5 136.32 57.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 176.29 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.4 m -128.36 126.59 41.0 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.29 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.42 ' HB2' ' OG1' ' A' ' 51' ' ' THR . 67.8 m95 -108.29 137.84 45.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.794 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.03 165.15 34.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.175 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.717 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 24.1 t -79.61 173.27 12.76 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 173.765 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HG23 ' A' ' 84' ' ' VAL . 52.7 tt0 -53.3 -33.67 54.22 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.15 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.4 t -77.52 -7.74 56.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.801 0.334 . . . . 0.0 111.473 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.16 30.44 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.554 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.717 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 9.9 pt-20 -89.2 124.85 63.79 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.34 142.59 94.96 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.712 2.941 . . . . 0.0 114.489 -168.153 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.3 mt -120.47 147.39 45.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.524 175.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 23.1 mm-40 -63.26 106.63 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.319 0.58 . . . . 0.0 111.059 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 18.5 m -113.13 130.94 56.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.915 -177.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -103.37 120.0 39.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.747 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 71.9 mt -134.98 119.51 27.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.356 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -108.67 142.8 38.63 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.652 HG12 ' H ' ' A' ' 57' ' ' GLU . 54.2 t 68.34 117.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 123.837 0.711 . . . . 0.0 110.175 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptp -75.75 7.91 3.45 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.194 0.521 . . . . 0.0 111.519 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.652 ' H ' HG12 ' A' ' 55' ' ' VAL . 49.4 mt-10 -125.05 159.19 31.94 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 p -73.18 148.0 44.21 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.429 ' HE2' ' HB ' ' A' ' 55' ' ' VAL . 37.0 m170 -91.3 128.91 45.28 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.135 -163.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.614 ' HA ' ' O ' ' A' ' 63' ' ' THR . 78.7 Cg_endo -97.18 -174.11 0.21 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.527 2.818 . . . . 0.0 112.946 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 63.46 91.11 0.07 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.157 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.99 -37.65 3.36 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.758 HG22 ' H ' ' A' ' 65' ' ' SER . 15.8 m -133.37 160.46 37.28 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -131.47 23.86 4.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.765 0.793 . . . . 0.0 109.453 173.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.758 ' H ' HG22 ' A' ' 63' ' ' THR . 19.3 m -112.65 167.98 10.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.927 -169.233 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -108.38 155.25 20.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 172.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -130.6 141.37 50.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.108 0.48 . . . . 0.0 110.391 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.572 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.56 123.09 2.79 Favored Glycine 0 N--CA 1.437 -1.288 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.687 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.7 p -125.48 131.37 72.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 120.959 0.409 . . . . 0.0 111.187 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.561 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.33 142.47 46.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.294 -177.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 m -98.63 114.03 26.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.501 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.1 m -123.01 165.97 18.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.6 t -78.02 151.81 33.35 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.2 -29.26 46.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 4.3 mm-40 -66.29 -32.71 74.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.413 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -60.39 -45.4 93.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.352 0.596 . . . . 0.0 109.512 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.564 ' CD1' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -72.04 -35.0 69.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.431 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 72.1 m-20 -67.03 -32.77 74.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.373 178.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -95.34 11.67 31.84 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? 63.38 38.67 9.94 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.293 0.371 . . . . 0.0 111.986 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -66.03 154.7 38.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -119.92 139.79 51.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.211 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.407 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 78.9 m-85 -128.29 160.64 31.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.609 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.597 HG23 ' HA ' ' A' ' 44' ' ' GLN . 69.5 t -125.23 125.17 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.337 -178.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 33.9 t -105.76 132.28 52.07 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.588 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -121.14 134.0 55.22 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -179.292 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.42 125.9 72.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.846 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -123.12 105.64 10.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.193 0.521 . . . . 0.0 110.451 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.573 ' CG ' HD13 ' A' ' 37' ' ' LEU . 1.1 t60 -101.02 -10.53 20.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.086 -177.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.636 ' HD3' ' O ' ' A' ' 90' ' ' ARG . 1.0 OUTLIER 74.1 -0.7 3.28 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 0.0 109.417 -170.973 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 4' ' ' ILE . 24.0 t0 -72.56 -36.62 68.27 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.156 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.19 154.23 58.47 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.372 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -75.16 -21.86 15.14 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.956 2.437 . . . . 0.0 112.779 -177.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.1 m -130.1 119.58 18.84 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.106 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.588 ' HB2' HG22 ' A' ' 86' ' ' THR . 50.6 Cg_endo -69.1 143.24 53.32 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.866 2.377 . . . . 0.0 112.725 -177.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -81.2 142.0 33.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.562 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 19.7 ptpt -116.53 143.08 46.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.023 0.439 . . . . 0.0 111.059 179.529 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 48.1 mmtt -122.01 140.83 52.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.608 178.42 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -101.14 146.33 27.61 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 tt -144.9 137.72 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.007 -0.677 . . . . 0.0 112.43 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 p -159.21 142.9 14.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.564 ' HD3' ' CD1' ' A' ' 77' ' ' TRP . 20.8 pttp . . . . . 0 C--O 1.247 0.953 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.444 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.685 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 19.6 ptp . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 99.57 -176.6 28.9 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.768 -0.729 . . . . 0.0 111.772 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -82.69 125.55 31.36 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.54 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.3 mt -60.2 121.78 8.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.636 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 30' ' ' ASN . 83.9 mt -104.15 131.02 51.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.115 0.484 . . . . 0.0 111.413 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -121.59 119.45 31.94 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.648 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -116.29 132.27 56.71 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 98' ' ' LYS . 6.6 p -112.45 131.02 55.78 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.234 0.54 . . . . 0.0 110.701 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.9 mm -117.74 123.96 29.26 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.785 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 43.5 Cg_endo -67.33 139.22 49.1 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.203 1.935 . . . . 0.0 110.391 173.728 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.53 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 56.5 Cg_endo -63.77 132.38 34.78 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.053 1.836 . . . . 0.0 110.658 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.5 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 15.4 t -78.5 145.39 34.97 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.852 -176.641 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -59.57 -29.39 67.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.323 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.415 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -65.53 -46.45 79.54 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 174.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 12' ' ' SER . 31.0 m-20 -64.96 -43.6 92.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.607 -179.381 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.5 mt -58.32 -34.65 50.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.581 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -72.14 -42.39 66.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.879 -178.508 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 14' ' ' ALA . 6.9 mp -59.9 -48.84 80.06 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.198 -176.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 p -94.6 -10.61 31.46 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 64.54 18.83 11.57 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.3 0.571 . . . . 0.0 110.884 -178.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.6 t -139.02 144.94 39.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.116 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.16 134.93 33.47 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 39.1 m-80 -137.0 116.82 13.1 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.151 -174.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -73.34 146.01 45.55 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.86 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.5 m -125.27 124.89 42.63 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.683 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.682 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 38.1 t -117.23 134.27 54.99 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.932 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -114.76 123.54 49.5 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.93 128.64 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.821 0.343 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.509 ' HA ' ' HB3' ' A' ' 58' ' ' SER . 68.6 m -144.02 172.29 13.08 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.822 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.46 HD22 HD12 ' A' ' 5' ' ' LEU . 96.5 m-20 60.27 52.19 5.05 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.893 0.746 . . . . 0.0 112.473 171.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.753 HD11 HD22 ' A' ' 37' ' ' LEU . 30.9 mt -75.87 153.43 36.78 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.16 177.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.685 ' HA ' ' HA ' ' A' ' 1' ' ' MET . . . -89.45 -50.64 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.53 0.205 . . . . 0.0 111.236 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.2 p -88.14 156.12 19.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.671 0.272 . . . . 0.0 110.958 177.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -90.78 16.21 9.71 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.807 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.559 ' O ' ' HE1' ' A' ' 89' ' ' HIS . 63.3 mm-40 -69.59 169.97 11.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.612 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.3 m -67.59 144.46 55.57 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.219 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.753 HD22 HD11 ' A' ' 31' ' ' LEU . 58.9 tp -105.03 145.98 29.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.133 0.492 . . . . 0.0 110.683 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -128.41 148.95 50.73 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.082 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.641 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -120.06 135.14 61.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.8 m -124.72 135.01 52.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.828 0.347 . . . . 0.0 110.832 -178.332 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.451 ' CH2' ' HB2' ' A' ' 85' ' ' CYS . 66.2 m95 -125.83 138.01 53.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.104 174.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.74 158.19 41.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.669 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 t -78.54 160.56 27.57 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -55.54 -32.0 62.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.089 0.471 . . . . 0.0 111.086 -179.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.03 -4.77 43.13 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.425 -178.036 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.04 22.97 28.71 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.394 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -92.37 122.12 65.17 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -64.78 144.09 82.43 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.772 2.315 . . . . 0.0 112.786 -177.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 49' ' ' LEU . 5.7 mt -120.4 146.39 46.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.41 0.624 . . . . 0.0 111.783 -178.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.33 118.2 11.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.936 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 53' ' ' ILE . 1.8 m -143.72 130.83 20.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.096 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -117.66 120.98 39.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 110.713 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.548 HD11 HG22 ' A' ' 51' ' ' THR . 4.0 mp -136.06 138.44 47.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.661 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -126.99 124.2 38.89 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.52 166.462 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.553 HG11 ' HB2' ' A' ' 66' ' ' ALA . 6.2 p -173.77 135.91 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 121.085 0.469 . . . . 0.0 111.231 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 50.7 tpp -108.06 -51.11 2.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.898 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -122.82 155.35 36.76 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 65' ' ' SER . 63.0 m -123.28 133.95 54.13 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.395 0.617 . . . . 0.0 112.21 -178.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.609 ' O ' ' HB ' ' A' ' 63' ' ' THR . 11.1 m80 -149.77 130.23 6.9 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.907 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD3' ' HB3' ' A' ' 29' ' ' SER . 63.0 Cg_endo -73.64 174.67 11.85 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.18 1.92 . . . . 0.0 114.438 -168.168 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.412 ' CG ' ' H ' ' A' ' 62' ' ' GLY . 60.1 t30 77.02 -152.55 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.951 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLY . . . . . 0.412 ' H ' ' CG ' ' A' ' 61' ' ' ASN . . . -74.15 60.58 2.26 Favored Glycine 0 C--N 1.335 0.513 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 176.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.756 HG22 ' H ' ' A' ' 64' ' ' PHE . 4.5 m -142.11 177.23 8.37 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -168.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.756 ' H ' HG22 ' A' ' 63' ' ' THR . 6.7 t80 -78.55 35.23 0.23 Allowed 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 124.725 1.21 . . . . 0.0 113.952 -162.173 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 21.1 p -95.49 172.85 7.82 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.126 -0.984 . . . . 0.0 109.24 -172.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.553 ' HB2' HG11 ' A' ' 55' ' ' VAL . . . -103.21 143.37 32.72 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.478 0.656 . . . . 0.0 111.974 -163.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 97.8 mttt -130.18 139.09 50.88 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.919 177.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.641 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -119.94 115.52 3.01 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.211 176.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -108.2 120.74 60.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.849 0.357 . . . . 0.0 110.209 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.66 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.97 132.45 56.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.905 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.0 m -98.0 118.95 35.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.191 0.52 . . . . 0.0 110.829 -174.684 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 24' ' ' LEU . 3.4 m -124.43 167.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.152 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.6 t -78.21 149.34 33.69 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -65.48 -27.28 41.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.802 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.12 -35.66 81.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.943 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -65.02 -42.23 94.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -73.8 -36.52 65.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.431 179.214 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 -73.16 -21.15 60.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.913 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -94.96 7.08 47.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.953 0.406 . . . . 0.0 110.209 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.5 ttp180 54.75 39.43 31.36 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.195 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -65.1 164.78 12.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.339 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -108.73 139.2 43.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.616 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.525 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 68.3 m-85 -124.77 148.9 47.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.723 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.1 t -117.6 127.17 75.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.842 -174.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.451 ' HB2' ' CH2' ' A' ' 41' ' ' TRP . 43.8 t -105.44 136.68 44.56 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 97' ' ' LYS . 1.0 OUTLIER -125.93 130.0 50.42 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 178.465 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.75 124.08 54.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.523 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.28 92.48 3.7 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.74 0.781 . . . . 0.0 110.395 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.559 ' HE1' ' O ' ' A' ' 35' ' ' GLU . 10.6 t60 -97.9 -9.22 26.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.294 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.33 17.66 11.07 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.542 -174.207 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -82.99 -27.89 30.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.001 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.52 153.87 77.97 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.177 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.23 -22.78 12.43 Favored 'Trans proline' 0 N--CA 1.465 -0.185 0 C-N-CA 123.076 2.517 . . . . 0.0 112.329 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.403 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 10.6 p -113.82 105.69 54.35 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.432 177.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 30.9 Cg_endo -64.14 141.49 76.47 Favored 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.573 2.182 . . . . 0.0 111.738 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -83.73 128.0 34.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.396 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.537 ' HG2' HG23 ' A' ' 86' ' ' THR . 49.7 mtmt -106.88 139.33 41.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.385 0.612 . . . . 0.0 111.074 178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 42.2 mmtt -118.15 130.71 56.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.686 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -101.45 121.87 42.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.947 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 10' ' ' PRO . 14.0 tt -123.79 139.22 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.114 0.483 . . . . 0.0 110.656 -178.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.1 t -158.1 150.65 22.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.218 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HE2' ' O ' ' A' ' 77' ' ' TRP . 37.2 ttpt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.799 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptt? . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.932 0.396 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -100.24 28.46 15.66 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.313 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -127.27 144.32 51.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.352 -0.424 . . . . 0.0 109.922 -176.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.55 HG12 ' HA ' ' A' ' 31' ' ' LEU . 76.1 mt -61.37 126.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.571 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.2 mt -104.69 129.74 52.83 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.228 0.537 . . . . 0.0 110.022 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.569 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.2 t -125.24 127.86 47.4 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.72 -179.038 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -123.91 142.06 51.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.43 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.8 p -113.6 135.0 54.39 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.523 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.14 121.9 31.87 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.1 138.89 34.52 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.665 2.243 . . . . 0.0 111.682 177.403 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.5 Cg_endo -68.62 146.88 68.71 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.467 2.111 . . . . 0.0 111.523 178.156 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 m -83.14 142.6 31.11 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.118 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -54.02 -43.77 70.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.658 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.88 -40.64 95.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.945 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.21 -39.38 93.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.09 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HG2' ' A' ' 11' ' ' PRO . 71.6 mt -64.55 -32.89 59.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.602 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -71.59 -37.05 71.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.327 -177.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 24.2 mt -67.41 -42.68 82.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.852 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.8 p -85.94 -21.28 27.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.427 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 20' ' ' LYS . 27.9 mmtp 66.97 6.19 4.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.213 -175.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.2 p -138.62 125.62 21.25 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.51 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -70.34 138.26 51.28 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.6 p30 -117.27 128.4 55.03 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.229 0.538 . . . . 0.0 110.227 -177.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.711 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 77.7 mt -91.22 122.63 34.01 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.635 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 56.5 m -111.19 123.82 50.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.266 0.555 . . . . 0.0 111.081 -176.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.479 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.1 t -117.89 137.21 52.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.559 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -121.56 123.58 42.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 87' ' ' VAL . 22.5 t -117.25 120.6 65.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 p -136.08 176.56 8.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.005 -173.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 12.7 m120 56.98 50.6 11.89 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.763 0.664 . . . . 0.0 111.769 175.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 37' ' ' LEU . 39.0 mt -74.5 128.91 36.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.683 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.81 -49.94 64.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.292 -176.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.434 HG22 ' OD2' ' A' ' 91' ' ' ASP . 5.8 t -113.15 147.61 37.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 173.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -93.95 132.21 38.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.353 0.596 . . . . 0.0 111.926 -176.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.817 ' HG2' ' H ' ' A' ' 36' ' ' THR . 35.3 tt0 -171.72 -171.5 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.817 ' H ' ' HG2' ' A' ' 35' ' ' GLU . 7.9 t -60.62 153.51 23.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 110.579 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 31' ' ' LEU . 43.6 tp -136.93 148.65 47.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.86 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 56.3 t30 -137.9 155.07 49.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.513 -177.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.489 HG22 HG21 ' A' ' 51' ' ' THR . 3.0 mp -120.76 135.34 61.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 174.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.3 m -129.6 122.86 29.94 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.658 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.612 ' HD1' HG23 ' A' ' 51' ' ' THR . 79.7 m95 -106.11 136.94 44.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.165 0.507 . . . . 0.0 110.829 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.56 141.0 18.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.87 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 44.6 t -70.57 151.3 45.18 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 175.636 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -64.57 -21.25 66.65 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.693 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.413 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 3.9 m -75.42 -4.72 41.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.108 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.68 23.16 26.66 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.852 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.548 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 23.7 mt-10 -95.46 120.77 63.2 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -178.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 11.8 Cg_exo -70.63 141.99 43.0 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.238 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.5 mt -126.53 141.5 51.85 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.103 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -80.67 107.25 13.32 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.356 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.612 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.6 m -97.3 132.46 43.02 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.489 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -111.47 123.02 49.35 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.349 -178.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.455 HG13 ' HA2' ' A' ' 68' ' ' GLY . 4.8 mp -128.19 125.57 64.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 174.952 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 55' ' ' VAL . 21.2 ptmt -96.01 138.95 32.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.554 HG12 ' H ' ' A' ' 57' ' ' GLU . 58.9 t 71.6 116.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.099 -167.241 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.9 mmm -75.95 9.2 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.422 0.63 . . . . 0.0 111.328 -174.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.554 ' H ' HG12 ' A' ' 55' ' ' VAL . 48.4 mt-10 -129.11 158.01 40.15 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.523 -178.973 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 t -74.48 151.77 39.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 10.7 m170 -91.08 128.09 48.98 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.286 -166.229 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' THR . 88.4 Cg_endo -100.13 -141.57 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.612 2.875 . . . . 0.0 114.258 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.462 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 49.1 m-80 76.08 -89.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.056 0.942 . . . . 0.0 110.379 -176.381 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.59 8.4 19.86 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 174.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.721 HG22 ' H ' ' A' ' 65' ' ' SER . 4.9 m -124.62 157.5 35.35 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.565 -0.818 . . . . 0.0 109.814 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -132.35 22.64 4.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.721 ' H ' HG22 ' A' ' 63' ' ' THR . 7.1 m -118.64 154.82 32.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.764 -163.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -115.15 160.56 19.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.936 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -130.46 140.93 50.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.455 ' HA2' HG13 ' A' ' 53' ' ' ILE . . . -141.01 124.11 2.48 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.711 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.4 p -119.0 135.98 57.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-O 121.011 0.434 . . . . 0.0 111.354 -174.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.491 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.9 147.87 40.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.708 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.8 m -99.44 114.34 27.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.839 0.352 . . . . 0.0 110.195 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.51 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.8 m -122.34 166.88 16.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.17 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.5 m -86.02 145.52 27.05 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 74' ' ' VAL . 2.4 t -60.06 -33.57 53.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 CA-C-O 121.676 0.751 . . . . 0.0 109.517 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.536 ' H ' ' CD ' ' A' ' 75' ' ' GLU . 1.8 mp0 -57.1 -37.44 71.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.893 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -62.34 -42.37 99.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.724 0.773 . . . . 0.0 109.015 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.541 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -69.87 -41.01 75.37 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.347 178.849 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -71.96 -21.79 61.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.481 -178.432 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -97.53 9.12 43.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.58 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 58.51 36.86 25.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.643 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 81' ' ' LYS . 51.2 mtpt -71.34 162.8 28.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.81 0.338 . . . . 0.0 110.8 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -106.98 137.8 44.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.188 0.518 . . . . 0.0 110.575 -177.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.541 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 76.1 m-85 -125.31 146.34 49.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.692 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 99.5 t -121.17 129.02 76.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.808 -176.272 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.757 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.2 p -107.11 123.28 48.0 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -112.17 131.1 55.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.107 -178.812 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 28' ' ' VAL . 40.2 t -105.46 127.33 60.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.989 -176.173 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.8 p -120.46 90.6 3.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.515 0.674 . . . . 0.0 110.669 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.555 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 11.3 t60 -99.44 -10.17 22.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.658 -175.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.523 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 8.2 tpt180 74.04 0.68 3.68 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.158 0.98 . . . . 0.0 109.853 -174.034 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.555 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.76 -36.4 65.09 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.286 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.34 154.84 80.71 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.701 -177.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.17 -31.37 12.07 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.929 2.419 . . . . 0.0 112.434 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 21.0 m -112.63 109.17 53.46 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.642 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 86' ' ' THR . 17.8 Cg_endo -59.68 140.27 92.75 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.569 2.179 . . . . 0.0 111.789 -178.468 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.2 143.49 31.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.452 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -128.59 144.07 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.439 -177.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.757 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 69.6 mmtt -126.28 146.59 49.95 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.197 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.26 129.69 55.5 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 8' ' ' THR . 15.0 tt -131.31 138.73 52.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.84 0.352 . . . . 0.0 110.57 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.3 m -157.14 150.41 23.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.776 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 22.2 tptm . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.661 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.07 55.29 0.99 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.967 178.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -98.03 113.2 25.0 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.661 0.267 . . . . 0.0 110.428 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.645 HG23 HD23 ' A' ' 31' ' ' LEU . 93.8 mt -84.3 125.63 40.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 174.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' ' 30' ' ' ASN . 1.5 mm? -100.81 130.52 46.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.183 0.516 . . . . 0.0 110.245 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.551 HG21 HG11 ' A' ' 87' ' ' VAL . 23.4 p -117.88 135.45 54.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.025 -178.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -133.43 143.54 48.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.519 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 p -113.84 136.97 52.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.199 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 38.6 mm -117.27 125.03 28.5 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.885 0.374 . . . . 0.0 110.699 -176.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.43 140.15 21.4 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.075 2.517 . . . . 0.0 112.212 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.78 152.11 74.13 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.949 2.432 . . . . 0.0 112.249 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.451 ' HB3' ' OD1' ' A' ' 15' ' ' ASP . 47.9 t -90.98 151.68 20.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.308 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HE1' ' HE3' ' A' ' 102' ' ' LYS . 58.2 m-85 -60.93 -31.86 71.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.242 -174.442 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.5 75.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.628 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.3 m-20 -74.48 -24.96 59.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.363 0.602 . . . . 0.0 110.72 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 22' ' ' ALA . 69.8 mt -74.48 -25.27 19.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.651 0.739 . . . . 0.0 109.384 172.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -73.7 -47.62 38.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.355 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.766 HD13 ' H ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -77.94 -36.36 49.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.362 0.601 . . . . 0.0 111.547 -169.971 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.766 ' H ' HD13 ' A' ' 18' ' ' LEU . 24.1 t -89.85 -8.45 51.95 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.988 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.3 mttm 59.07 16.32 4.67 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.015 -178.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.1 m -139.77 152.81 46.89 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.516 ' O ' HG22 ' A' ' 72' ' ' VAL . . . -94.09 122.61 36.78 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.473 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 55.1 m-80 -106.28 128.35 53.91 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.429 0.633 . . . . 0.0 111.071 -174.285 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 85.9 mt -84.29 138.01 33.15 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.886 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 89.7 m -124.92 117.63 24.49 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.38 0.61 . . . . 0.0 110.497 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.574 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.6 t -109.93 131.99 54.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.417 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.1 tt -126.24 130.67 51.37 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.171 0.51 . . . . 0.0 110.54 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG12 HD21 ' A' ' 31' ' ' LEU . 44.9 t -122.36 125.28 72.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.754 -178.691 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' SER . . . . . 0.55 ' HB3' ' OG ' ' A' ' 65' ' ' SER . 14.5 p -138.91 176.26 8.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.226 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ASN . . . . . 0.483 ' HB2' HD23 ' A' ' 5' ' ' LEU . 3.8 m-20 59.05 46.7 13.0 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.644 0.59 . . . . 0.0 111.041 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.668 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 15.8 mt -79.74 160.23 26.3 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.99 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.79 -22.34 15.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.694 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 0.2 OUTLIER 68.25 52.27 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 112.87 -1.968 . . . . 0.0 112.68 163.45 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -84.02 -6.61 59.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.647 173.236 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 7.9 tp10 -164.27 168.02 19.24 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.91 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 56' ' ' MET . 7.1 p -69.13 171.36 8.43 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.794 178.645 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.667 HD13 ' N ' ' A' ' 38' ' ' ASN . 1.9 tm? -122.71 161.29 24.16 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.65 -175.69 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.667 ' N ' HD13 ' A' ' 37' ' ' LEU . 65.1 t30 -152.75 154.22 34.79 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 20.2 mm -119.74 135.82 58.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -132.06 135.16 46.28 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.732 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.574 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 56.9 m95 -116.74 138.6 51.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.024 0.44 . . . . 0.0 110.818 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -150.23 162.29 40.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.322 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 36.6 t -74.82 168.07 20.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -63.67 -24.35 67.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.928 0.394 . . . . 0.0 111.391 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.7 m -83.55 3.38 32.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.408 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.48 22.13 54.7 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.861 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 36.3 mt-10 -87.46 121.78 70.98 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -178.334 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 48.3 Cg_exo -56.38 142.67 88.42 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 123.326 2.684 . . . . 0.0 113.28 -175.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 49' ' ' LEU . 4.5 mt -123.17 146.8 47.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.713 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.63 108.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.96 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.449 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 8.5 m -131.56 131.08 43.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.145 -177.145 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -113.94 122.73 47.86 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.155 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.493 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 50.6 mm -122.31 120.14 60.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.141 -178.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -107.52 136.83 46.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.259 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.709 HG12 ' H ' ' A' ' 57' ' ' GLU . 36.9 t 72.19 111.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.005 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.429 ' O ' ' HB ' ' A' ' 36' ' ' THR . 92.8 mmm -74.72 10.16 1.51 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.553 0.692 . . . . 0.0 111.154 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.709 ' H ' HG12 ' A' ' 55' ' ' VAL . 42.7 mt-10 -121.46 157.26 30.99 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -177.937 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.3 m -75.06 146.56 41.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -174.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.493 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 50.2 m170 -91.85 129.27 42.74 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.528 -168.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.656 ' HA ' ' O ' ' A' ' 63' ' ' THR . 10.4 Cg_endo -91.4 -148.82 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 123.565 2.843 . . . . 0.0 112.112 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 63.58 68.38 0.6 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.13 0.49 . . . . 0.0 110.186 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.84 12.63 83.28 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -178.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.656 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 3.3 m -145.41 153.71 41.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -177.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -132.2 22.93 4.47 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 174.628 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.638 ' H ' HG22 ' A' ' 63' ' ' THR . 8.2 m -129.91 171.91 12.24 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.073 -165.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.539 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.12 150.03 28.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.369 175.401 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 20.4 ttmm -131.58 139.31 49.16 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -132.92 128.76 5.23 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.61 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.576 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.6 t -114.43 125.01 71.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.728 0.299 . . . . 0.0 111.24 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.473 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -118.44 146.76 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.068 175.816 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.4 m -100.33 122.29 42.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.825 0.345 . . . . 0.0 110.662 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 22' ' ' ALA . 1.5 m -122.42 167.24 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.36 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -71.76 143.01 49.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.85 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -61.8 -35.25 66.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.818 0.818 . . . . 0.0 108.85 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.89 -32.35 74.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.787 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.02 -47.62 83.93 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.584 ' HH2' HG12 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -67.87 -42.83 80.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.754 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.64 -28.0 68.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.534 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -89.43 7.39 36.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.602 0.239 . . . . 0.0 110.739 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 64.81 37.32 7.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.007 176.53 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 81' ' ' LYS . 26.7 mmmt -72.44 160.01 33.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.185 178.434 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -124.06 138.82 54.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.806 -177.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 90.9 m-85 -122.73 160.98 24.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.705 -178.282 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.1 t -124.62 128.89 73.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.056 0.455 . . . . 0.0 110.854 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.744 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 26.4 p -106.5 142.98 35.27 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.02 176.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -122.48 121.59 36.93 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.255 0.55 . . . . 0.0 110.999 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.645 HG23 HD21 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -104.27 134.96 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.353 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.8 92.92 3.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.307 0.575 . . . . 0.0 110.425 -173.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.694 ' CE1' ' HA ' ' A' ' 33' ' ' THR . 3.2 t-160 -99.03 -10.98 21.92 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.25 9.78 2.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.773 0.797 . . . . 0.0 110.092 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.499 ' HB3' HD11 ' A' ' 4' ' ' ILE . 43.9 t0 -101.7 -23.67 14.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.959 -173.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.498 HD22 ' HG3' ' A' ' 96' ' ' GLN . 0.4 OUTLIER -108.55 160.33 27.58 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.058 179.718 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.13 -32.51 94.72 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.115 1.877 . . . . 0.0 112.826 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.413 ' O ' HD13 ' A' ' 92' ' ' LEU . 23.1 t -153.68 141.7 13.91 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -177.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.92 140.8 47.84 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.011 2.474 . . . . 0.0 111.571 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.498 ' HG3' HD22 ' A' ' 92' ' ' LEU . 41.8 mt-30 -89.68 130.02 36.02 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.805 -175.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 52.3 mtmt -101.9 126.82 48.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.374 176.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.744 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -123.3 141.94 51.46 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.94 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -99.7 142.79 30.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.899 -176.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.584 HG12 ' HH2' ' A' ' 77' ' ' TRP . 13.6 tt -134.87 137.56 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.152 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.9 t -157.97 149.84 21.84 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.108 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.562 ' HE3' ' HE1' ' A' ' 13' ' ' PHE . 76.4 tttt . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.495 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 ppp? . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.965 0.412 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.606 ' HA3' ' HB2' ' A' ' 32' ' ' ALA . . . 166.21 -44.91 0.27 Allowed Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 66.74 72.69 0.37 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.598 0.713 . . . . 0.0 111.799 172.222 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.636 HG23 HD23 ' A' ' 31' ' ' LEU . 76.2 mt -64.64 122.93 16.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.051 176.358 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.1 mt -109.48 130.58 55.49 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.93 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.9 t -111.4 133.48 53.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.325 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -125.21 142.27 51.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.725 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.2 p -115.6 136.81 52.7 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.909 0.385 . . . . 0.0 111.129 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.491 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -118.71 125.98 27.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.022 178.354 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -78.94 139.57 15.46 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.786 2.324 . . . . 0.0 111.622 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -69.96 149.77 66.05 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.573 2.182 . . . . 0.0 111.81 178.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.467 ' O ' HG13 ' A' ' 16' ' ' ILE . 21.8 m -88.26 137.3 32.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.403 -177.326 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.55 ' HA ' HD12 ' A' ' 16' ' ' ILE . 75.6 t80 -54.18 -37.39 64.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.772 -1.103 . . . . 0.0 112.996 -169.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.38 -46.56 69.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.82 0.343 . . . . 0.0 110.653 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.95 -38.93 93.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.664 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 13' ' ' PHE . 89.1 mt -58.26 -39.85 75.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.798 176.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -69.41 -44.6 71.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.805 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 18' ' ' LEU . 4.4 mm? -69.87 -44.6 69.47 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.331 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -70.8 -7.66 46.87 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.884 -178.277 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 72.48 -18.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.549 0.739 . . . . 0.0 111.517 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 19' ' ' SER . 57.4 m -138.72 162.35 34.9 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 176.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.563 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -99.19 159.32 15.07 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.518 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -128.08 134.54 49.17 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.237 0.542 . . . . 0.0 110.384 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 70.8 mt -88.35 126.04 35.0 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.491 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 62.7 m -111.0 112.32 24.06 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.413 0.625 . . . . 0.0 111.065 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.512 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 37.7 t -111.77 129.12 56.23 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.322 176.663 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -124.1 123.35 40.13 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 87' ' ' VAL . 12.0 t -118.15 119.95 62.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.426 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.2 t -135.04 178.2 7.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.33 -174.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.8 41.86 20.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.345 0.593 . . . . 0.0 110.764 -176.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.636 HD23 HG23 ' A' ' 4' ' ' ILE . 43.4 mt -70.38 126.14 28.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.745 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.606 ' HB2' ' HA3' ' A' ' 2' ' ' GLY . . . -56.35 -31.21 63.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.352 -175.716 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 70.9 p -125.98 -1.5 7.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.372 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.474 ' HA ' ' HB2' ' A' ' 31' ' ' LEU . 80.5 m-85 52.51 -127.68 2.42 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.399 -171.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 33' ' ' THR . 47.7 mt-10 61.06 -144.84 0.46 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.277 0.56 . . . . 0.0 111.933 176.329 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.973 HG23 ' HA ' ' A' ' 56' ' ' MET . 10.3 m -67.6 135.65 53.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.744 -176.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 66' ' ' ALA . 47.5 tp -142.0 161.49 37.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.936 178.343 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -132.01 151.34 51.8 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.577 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.0 mm -121.08 140.29 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.242 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -142.19 135.68 29.18 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 122.019 -0.426 . . . . 0.0 111.456 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.521 ' HD1' HG21 ' A' ' 51' ' ' THR . 67.6 m95 -119.21 149.88 41.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.888 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.45 144.67 18.46 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.192 175.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -65.09 163.17 15.4 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.351 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 31.1 tt0 -53.43 -31.6 46.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.228 0.537 . . . . 0.0 110.941 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.8 t -72.87 -0.68 14.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.075 -178.733 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.51 17.77 67.82 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.57 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.477 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 52.5 mt-10 -93.99 127.86 43.52 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -176.115 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.7 Cg_exo -57.97 136.32 74.36 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 123.036 2.491 . . . . 0.0 112.911 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.688 HD12 ' HB1' ' A' ' 70' ' ' ALA . 0.3 OUTLIER -97.69 146.84 24.94 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.915 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 6.8 tp10 -67.31 104.67 1.55 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.292 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.791 HG22 HD11 ' A' ' 53' ' ' ILE . 1.7 m -145.79 128.51 16.23 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.287 -177.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -123.19 120.09 32.14 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.694 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.791 HD11 HG22 ' A' ' 51' ' ' THR . 3.3 mp -136.83 128.8 43.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.277 178.582 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -130.58 105.12 7.63 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.028 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 53' ' ' ILE . 4.0 m -140.27 91.28 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.64 0.733 . . . . 0.0 110.747 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.973 ' HA ' HG23 ' A' ' 36' ' ' THR . 66.2 mtt -77.41 2.56 15.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.025 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -150.81 154.39 37.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.851 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 64' ' ' PHE . 12.9 m -76.86 136.02 38.88 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 1.4 m-70 -93.58 130.17 36.09 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -167.206 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.488 ' HA ' ' O ' ' A' ' 63' ' ' THR . 1.0 OUTLIER -85.72 134.03 4.53 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.551 2.834 . . . . 0.0 111.779 174.082 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -178.87 43.75 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.17 -4.93 84.73 Favored Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -170.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.488 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 0.8 OUTLIER -141.4 169.3 17.86 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.451 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 58' ' ' SER . 65.0 m-85 -124.08 26.88 7.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.418 0.628 . . . . 0.0 110.054 -175.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.8 p -111.74 174.29 5.95 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.976 -164.956 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.768 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -106.84 148.2 28.82 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.92 171.085 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HE2' HG23 ' A' ' 25' ' ' THR . 63.5 tttm -132.31 139.23 48.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -175.368 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.577 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.97 133.98 7.81 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.782 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 45.7 t -114.49 124.21 70.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.688 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -114.85 155.98 25.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.4 179.112 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 m -108.41 121.35 44.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.673 0.273 . . . . 0.0 110.998 -172.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.563 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 4.2 m -128.34 153.35 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.211 0.529 . . . . 0.0 110.115 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 m -77.5 145.93 36.71 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.994 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.414 HG22 HG22 ' A' ' 16' ' ' ILE . 25.9 t -58.03 -33.57 46.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.463 0.649 . . . . 0.0 109.663 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -57.63 -42.34 83.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.222 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -67.58 -41.35 84.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.684 ' CD1' ' HG2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -68.98 -35.14 76.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.185 179.468 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -69.62 -26.28 64.36 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.052 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -91.51 7.1 42.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.028 0.442 . . . . 0.0 110.004 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 60.02 39.13 20.27 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.582 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.561 ' HA ' ' HE2' ' A' ' 81' ' ' LYS . 3.2 mmpt? -56.67 147.45 22.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.962 174.344 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.455 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -115.0 139.33 49.94 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.882 178.042 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -125.5 158.09 35.36 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.524 -176.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 76.6 t -123.06 125.52 72.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.575 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.8 p -105.76 135.44 47.17 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.478 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.2 OUTLIER -125.31 136.29 53.33 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 28' ' ' VAL . 28.8 t -110.57 127.72 67.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.829 0.347 . . . . 0.0 111.154 -175.704 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 p -114.85 90.17 3.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.418 0.628 . . . . 0.0 111.409 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -98.66 -15.41 19.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.667 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 90' ' ' ARG . 0.1 OUTLIER 64.12 24.02 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.486 -178.548 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -98.91 -36.51 9.74 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.51 0.671 . . . . 0.0 109.462 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -100.08 148.03 34.29 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.808 172.41 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.53 -22.48 38.45 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.269 2.646 . . . . 0.0 112.884 -172.109 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' HD13 ' A' ' 92' ' ' LEU . 14.3 m -132.88 130.07 21.4 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 24.5 Cg_exo -62.56 141.0 84.59 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.464 2.109 . . . . 0.0 112.139 -178.645 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.4 pt20 -87.99 142.01 28.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.395 -178.58 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 20.1 ptmt -127.17 148.47 50.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.225 0.536 . . . . 0.0 111.209 -175.74 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 61.6 mmtt -134.15 145.6 49.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.611 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.48 ' CD1' HG22 ' A' ' 84' ' ' VAL . 34.3 m-85 -105.7 142.69 35.01 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.073 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 9.7 tt -142.38 138.12 29.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.766 0.317 . . . . 0.0 111.191 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 p -158.34 148.66 20.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.775 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.684 ' HG2' ' CD1' ' A' ' 77' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.822 -0.609 . . . . 0.0 110.022 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttp . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.731 0.301 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.18 152.42 22.17 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.55 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -92.64 132.46 36.87 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.611 HG12 ' HA ' ' A' ' 31' ' ' LEU . 64.5 mt -59.61 121.65 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.51 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -103.98 131.05 51.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.515 -176.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.475 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 11.6 p -117.5 122.17 42.97 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.427 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -133.92 145.41 49.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.034 0.445 . . . . 0.0 110.406 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.8 p -115.41 135.91 53.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.317 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.15 121.82 31.96 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.543 ' HA ' HD11 ' A' ' 100' ' ' ILE . 59.4 Cg_endo -70.44 140.01 39.15 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.751 2.301 . . . . 0.0 111.654 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HG2' HD11 ' A' ' 16' ' ' ILE . 66.1 Cg_endo -68.88 144.96 60.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.26 1.973 . . . . 0.0 110.806 176.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -79.2 138.15 37.72 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -54.05 -42.59 69.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.72 0.295 . . . . 0.0 111.287 -170.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.4 -38.25 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.339 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -66.27 -35.9 81.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.059 0.457 . . . . 0.0 110.349 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.479 HD11 ' HG2' ' A' ' 11' ' ' PRO . 53.7 mt -67.36 -32.04 55.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.01 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -66.49 -36.94 83.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.652 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.0 mt -76.82 -48.01 19.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.006 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.7 m -80.53 -10.35 59.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.408 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 63.2 mmtt 71.05 -57.09 0.61 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.557 0.743 . . . . 0.0 111.739 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 20.0 m -95.08 127.17 40.93 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 176.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.541 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -60.97 145.53 50.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.777 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -120.62 124.53 45.48 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.302 0.572 . . . . 0.0 110.558 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 83.5 mt -83.36 130.52 35.06 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.807 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 m -115.26 122.76 46.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.183 0.516 . . . . 0.0 111.139 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.409 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.9 t -111.27 138.47 47.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.723 -178.681 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -126.19 122.45 35.67 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 t -127.86 120.83 54.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 t -137.43 177.08 8.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.5 -173.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.6 35.8 24.74 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.116 0.566 . . . . 0.0 112.048 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.676 ' HB2' ' HA ' ' A' ' 34' ' ' TYR . 48.9 mt -60.07 124.95 21.82 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.39 -25.87 60.19 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -170.316 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 35' ' ' GLU . 12.7 t -129.86 7.55 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.633 0.254 . . . . 0.0 110.86 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.676 ' HA ' ' HB2' ' A' ' 31' ' ' LEU . 48.9 m-85 56.51 -87.36 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.77 -171.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.863 ' HG3' ' H ' ' A' ' 36' ' ' THR . 6.8 tp10 55.02 -154.23 0.3 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.027 0.441 . . . . 0.0 111.467 170.514 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.863 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 8.1 t -85.69 163.63 18.13 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.553 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.533 ' HB3' ' OG ' ' A' ' 58' ' ' SER . 66.4 tp -160.08 151.26 19.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 179.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.8 m-20 -119.51 152.66 36.59 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.3 mm -120.43 135.82 59.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 m -139.27 125.84 20.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.077 0.465 . . . . 0.0 111.531 -176.493 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.546 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 85.8 m95 -106.81 148.2 28.79 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.122 174.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.0 156.13 36.83 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 22.8 m -87.84 156.8 19.21 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -60.24 -19.98 56.9 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -72.76 -7.35 50.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.211 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.8 18.24 41.44 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.041 176.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 13.2 pt-20 -101.81 133.9 20.48 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 120.507 0.194 . . . . 0.0 110.745 -177.222 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 12.1 Cg_exo -69.78 136.79 33.81 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.676 2.251 . . . . 0.0 112.416 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.0 mt -106.08 142.02 36.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.62 177.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -64.57 106.72 1.21 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.938 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 12.2 m -104.89 116.78 32.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.804 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -93.99 120.8 34.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.528 0.68 . . . . 0.0 110.447 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.56 HD11 ' HB ' ' A' ' 39' ' ' ILE . 41.8 mt -134.44 138.87 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.923 -176.153 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.51 ' HD2' ' C ' ' A' ' 53' ' ' ILE . 3.6 mptp? -121.95 147.07 46.5 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 173.248 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.49 HG12 ' H ' ' A' ' 57' ' ' GLU . 57.9 t 75.55 116.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 123.98 0.8 . . . . 0.0 109.898 -174.004 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 93.2 mmm -79.22 8.84 5.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.357 -172.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.49 ' H ' HG12 ' A' ' 55' ' ' VAL . 13.4 pt-20 -130.53 153.33 48.95 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.533 ' OG ' ' HB3' ' A' ' 37' ' ' LEU . 28.8 m -82.1 162.36 22.54 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.691 ' HB2' ' HB ' ' A' ' 63' ' ' THR . 96.2 m-70 -100.77 126.96 33.65 Favored Pre-proline 0 C--N 1.32 -0.698 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.989 -174.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -103.29 -0.95 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 123.834 3.023 . . . . 0.0 112.045 170.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.443 ' C ' ' H ' ' A' ' 63' ' ' THR . 45.1 t-20 -142.37 128.14 19.3 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 -174.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.79 -30.74 2.55 Favored Glycine 0 CA--C 1.517 0.209 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -174.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.691 ' HB ' ' HB2' ' A' ' 59' ' ' HIS . 7.1 m -144.28 158.1 43.92 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 173.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -121.21 23.62 10.42 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 118.407 0.549 . . . . 0.0 110.971 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.5 p -156.18 172.74 17.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.659 0.742 . . . . 0.0 112.885 -170.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.428 ' HB2' ' OG ' ' A' ' 58' ' ' SER . . . -108.71 148.34 30.61 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.112 167.298 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -131.48 140.64 49.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.69 127.49 4.11 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.608 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.581 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 43.3 t -115.08 128.29 72.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.759 0.314 . . . . 0.0 110.596 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -116.53 148.64 40.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.69 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 m -99.93 124.1 44.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.266 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.541 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.6 m -119.73 166.96 13.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.471 ' HB3' ' OD2' ' A' ' 76' ' ' ASP . 23.2 t -86.68 154.29 21.1 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.193 -178.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.37 -39.66 85.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.076 0.465 . . . . 0.0 110.67 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -58.36 -36.24 73.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.789 -178.159 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 73' ' ' SER . 13.3 m-20 -63.94 -45.02 91.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.335 0.588 . . . . 0.0 110.094 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.457 ' HE1' ' HD2' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.5 -35.07 68.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.196 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -65.76 -30.22 70.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.235 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ASN . . . . . 0.401 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 95.3 m-20 -90.85 7.27 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.096 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 57.89 36.77 26.6 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.387 0.43 . . . . 0.0 110.912 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 31.6 mmmt -68.93 163.31 24.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.336 -177.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 51.3 mt-10 -114.69 139.75 49.41 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.507 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 99' ' ' PHE . 75.1 m-85 -121.14 157.29 30.47 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.792 177.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 93.5 t -120.75 129.0 76.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 0.0 110.967 -176.059 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.546 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 34.9 t -106.18 127.62 53.34 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.12 126.16 52.38 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.466 ' CG1' HD11 ' A' ' 37' ' ' LEU . 54.1 t -105.9 125.67 61.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.143 0.497 . . . . 0.0 111.1 -177.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.1 p -120.56 103.9 9.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.731 ' ND1' ' HB2' ' A' ' 91' ' ' ASP . 39.6 t-80 -98.39 -20.37 17.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.048 -176.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.509 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 18.9 ttt180 74.04 8.13 4.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.008 0.908 . . . . 0.0 108.786 -169.801 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.731 ' HB2' ' ND1' ' A' ' 89' ' ' HIS . 11.2 t0 -93.58 -36.41 12.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.773 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.419 HD12 ' O ' ' A' ' 92' ' ' LEU . 0.7 OUTLIER -119.32 151.96 51.88 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.319 178.501 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.58 -31.33 11.05 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 123.017 2.478 . . . . 0.0 112.801 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.3 m -116.77 111.54 41.17 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.168 -176.802 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.91 141.25 83.63 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.257 1.971 . . . . 0.0 111.939 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -86.43 127.4 34.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -112.76 128.31 56.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.305 178.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 64.5 mmtt -122.77 149.32 44.27 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.023 -174.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PHE . . . . . 0.419 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.4 m-85 -105.73 146.79 29.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.966 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.8 tt -136.34 138.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.265 175.324 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.428 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 10.7 t -158.85 149.92 20.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.523 177.726 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.821 ' HE2' ' HA ' ' A' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.558 -0.735 . . . . 0.0 110.321 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.5 ttm . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.854 0.359 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.06 -86.75 0.12 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.974 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -78.69 118.45 20.79 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.592 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.1 mt -70.7 123.12 24.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.264 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.1 mt -104.95 131.03 52.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.009 0.433 . . . . 0.0 110.345 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.415 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 13.9 p -109.42 123.48 49.42 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.843 -179.067 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -119.32 131.39 55.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 3.2 p -119.51 131.57 55.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.369 176.273 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.88 124.48 28.75 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.975 0.417 . . . . 0.0 110.495 -178.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.41 140.73 24.69 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.886 2.391 . . . . 0.0 111.507 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.551 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 51.8 Cg_endo -64.85 147.41 89.44 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.578 2.185 . . . . 0.0 111.845 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.403 ' O ' HG13 ' A' ' 16' ' ' ILE . 10.7 p -89.56 146.44 24.58 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.136 -177.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PHE . . . . . 0.83 ' HE1' ' HE2' ' A' ' 102' ' ' LYS . 47.9 m-85 -59.76 -31.39 69.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.446 -174.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.15 76.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.563 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.02 -35.07 66.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.502 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 12' ' ' SER . 83.1 mt -63.46 -32.02 55.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.461 176.11 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -62.99 -43.93 97.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.405 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.98 -47.87 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.422 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.6 m -70.69 -24.24 62.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.972 -177.188 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt 70.94 -6.07 1.36 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.496 0.718 . . . . 0.0 111.368 -177.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 71.3 p -137.9 161.99 35.2 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.73 32.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -125.88 130.26 50.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.986 0.422 . . . . 0.0 110.057 -177.562 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 88.6 mt -86.29 128.91 34.99 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.45 -176.574 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' THR . . . . . 0.409 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 18.2 m -109.05 114.4 28.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.504 -178.92 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.597 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 25.3 t -114.05 134.82 54.61 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.117 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -135.97 129.11 31.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.142 0.496 . . . . 0.0 110.109 175.977 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.633 ' HB ' HD21 ' A' ' 37' ' ' LEU . 15.4 t -123.35 132.87 70.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -143.3 171.84 13.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.156 0.503 . . . . 0.0 111.557 -173.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 64.51 48.95 2.53 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.173 169.821 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.592 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -72.79 157.17 38.0 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.098 -1.41 . . . . 0.0 109.122 178.754 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.89 70.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.881 0.372 . . . . 0.0 110.926 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.5 t -158.58 151.08 21.88 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.351 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 65.64 91.97 0.08 Allowed 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.029 0.83 . . . . 0.0 111.274 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 58' ' ' SER . 37.7 mp0 -75.8 58.98 1.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.425 0.631 . . . . 0.0 111.089 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.532 HG23 ' HG2' ' A' ' 57' ' ' GLU . 11.3 m -93.62 -68.22 0.81 Allowed 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 171.625 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.633 HD21 ' HB ' ' A' ' 28' ' ' VAL . 18.8 tp 63.21 171.45 0.15 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.57 170.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.404 ' N ' ' HG ' ' A' ' 37' ' ' LEU . 64.3 t30 -143.49 151.05 39.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.307 -0.86 . . . . 0.0 108.911 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.729 HG21 ' HA3' ' A' ' 68' ' ' GLY . 17.5 mm -121.14 136.05 59.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.842 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 t -145.67 128.58 16.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.896 0.379 . . . . 0.0 110.863 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.597 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 55.2 m95 -108.7 149.03 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.474 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.55 163.81 38.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.622 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 t -84.68 168.69 15.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' GLU . 56.4 tt0 -57.37 -29.18 63.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.086 0.47 . . . . 0.0 110.85 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -73.66 -4.3 33.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.526 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.1 20.79 54.52 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.812 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.8 mt-10 -99.64 123.6 47.29 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 32.2 Cg_exo -58.66 137.55 80.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.154 2.569 . . . . 0.0 113.217 -173.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -106.34 148.35 28.14 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.664 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.514 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 39.4 mm-40 -62.71 106.59 0.82 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.808 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.595 HG22 HD11 ' A' ' 53' ' ' ILE . 3.1 m -117.68 113.88 22.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.874 -177.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -105.01 120.92 42.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.125 0.488 . . . . 0.0 110.957 -177.586 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.595 HD11 HG22 ' A' ' 51' ' ' THR . 4.1 mp -134.4 127.33 50.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.665 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -97.7 146.92 24.88 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.641 HG12 ' H ' ' A' ' 57' ' ' GLU . 42.2 t 75.68 120.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 O-C-N 124.043 0.839 . . . . 0.0 109.437 -169.771 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.7 mtt -84.89 8.39 17.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.921 -175.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLU . . . . . 0.641 ' H ' HG12 ' A' ' 55' ' ' VAL . 48.1 mt-10 -127.24 156.66 41.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.801 -177.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' SER . . . . . 0.499 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . 18.2 m -76.86 154.75 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 33.3 m170 -93.33 128.91 40.78 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.492 -171.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 96.2 Cg_endo -97.3 30.95 0.15 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 123.263 2.642 . . . . 0.0 112.631 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -104.01 106.95 17.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.176 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.67 -49.69 4.27 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.451 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 64' ' ' PHE . 1.6 m -137.08 169.43 17.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.454 ' H ' HG22 ' A' ' 63' ' ' THR . 91.1 m-85 -98.95 29.92 3.61 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 122.931 0.493 . . . . 0.0 111.41 -175.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -107.58 163.62 12.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.669 0.747 . . . . 0.0 112.859 -165.086 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.432 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.54 158.51 17.94 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.287 175.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -134.23 140.43 46.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.747 0.308 . . . . 0.0 110.462 -176.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.729 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -139.43 138.69 9.45 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -123.2 129.0 75.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.802 0.334 . . . . 0.0 110.78 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.61 150.49 37.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.406 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.4 m -102.63 119.85 39.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.8 m -127.19 166.4 23.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.977 0.418 . . . . 0.0 110.779 -176.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.566 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.8 m -85.16 137.62 32.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.271 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -65.67 -24.98 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.436 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.2 -33.95 76.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.034 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ASP . . . . . 0.566 ' OD1' ' HB2' ' A' ' 73' ' ' SER . 3.5 m-20 -66.11 -41.32 90.71 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.551 ' CZ2' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -65.86 -41.33 91.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.072 177.455 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 1.3 m120 -67.28 -30.07 69.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.995 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -91.38 8.01 38.28 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.214 -0.195 . . . . 0.0 111.061 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.97 37.26 21.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.467 -178.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -67.2 161.83 23.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.05 0.453 . . . . 0.0 110.146 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 45.8 mt-10 -112.65 140.53 47.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.42 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.9 m-85 -121.32 149.69 42.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.482 176.081 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 90.2 t -123.01 120.33 60.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.083 -173.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.7 p -105.67 135.32 47.3 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 95' ' ' PRO . 1.2 m -122.38 132.94 54.62 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.775 0.322 . . . . 0.0 110.156 -177.366 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.466 HG11 HG11 ' A' ' 28' ' ' VAL . 44.3 t -109.1 126.99 66.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.766 -178.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -117.8 88.5 2.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.59 0.709 . . . . 0.0 111.58 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.526 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 23.5 t60 -98.82 -6.89 28.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.514 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 0.1 OUTLIER 52.29 24.09 2.7 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.901 -175.169 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.411 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 29.0 t70 -94.05 -28.51 15.69 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.562 -179.22 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -118.23 156.07 51.01 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.049 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.52 -21.86 39.4 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.056 2.504 . . . . 0.0 113.106 -175.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.498 ' O ' HD13 ' A' ' 92' ' ' LEU . 37.5 p -134.63 125.0 17.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.499 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HB2' HG22 ' A' ' 86' ' ' THR . 18.0 Cg_endo -61.35 141.38 92.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.585 2.19 . . . . 0.0 111.412 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 86' ' ' THR . 33.2 mt-30 -80.58 126.73 31.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.964 0.411 . . . . 0.0 111.148 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -107.36 126.71 52.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.368 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.663 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 16.7 mmtt -115.27 133.78 55.73 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.967 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.21 122.75 44.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.799 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 12.5 tt -122.17 139.89 47.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.159 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -157.28 150.01 23.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.047 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.83 ' HE2' ' HE1' ' A' ' 13' ' ' PHE . 47.7 tttm . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.813 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 120.845 0.355 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.929 ' HA2' ' HB2' ' A' ' 32' ' ' ALA . . . -96.48 48.61 1.69 Allowed Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.672 -176.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -87.28 74.99 9.38 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 -173.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.6 HG23 HD23 ' A' ' 31' ' ' LEU . 73.5 mt -60.4 121.49 8.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.228 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.31 138.32 43.72 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.257 -176.133 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 28' ' ' VAL . 2.2 p -115.05 120.07 38.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.858 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -119.36 132.01 55.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 p -115.63 132.48 56.62 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.258 176.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.96 125.92 27.64 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.81 0.338 . . . . 0.0 110.427 -177.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . 0.47 ' HA ' HD11 ' A' ' 100' ' ' ILE . 55.9 Cg_endo -70.75 139.59 37.1 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.612 2.208 . . . . 0.0 111.444 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' HG2' HD11 ' A' ' 16' ' ' ILE . 55.7 Cg_endo -68.81 154.96 70.18 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.736 2.29 . . . . 0.0 112.447 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.438 ' O ' HG13 ' A' ' 16' ' ' ILE . 11.9 p -84.82 126.09 33.15 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 -177.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -61.4 -30.83 70.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.554 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -62.18 -40.28 95.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 177.134 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.04 -43.14 58.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.903 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.499 HD11 ' HG2' ' A' ' 11' ' ' PRO . 76.5 mt -57.69 -32.69 43.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.469 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.08 -39.0 93.41 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.43 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 41.1 mt -72.6 -48.14 42.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.557 -173.27 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.8 p -86.46 -18.16 32.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.865 0.364 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm 68.87 16.12 8.87 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.734 0.813 . . . . 0.0 110.117 -174.738 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -135.35 128.88 32.53 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.314 -176.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.14 136.61 32.86 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.613 176.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 48.8 m-80 -122.93 125.9 46.21 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.147 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 70.9 mt -83.46 131.08 35.04 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.003 -178.068 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.2 m -119.07 121.19 39.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.286 0.565 . . . . 0.0 110.949 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' CYS . . . . . 0.584 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.4 t -126.88 137.97 53.24 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.171 178.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 3.9 tt -133.5 132.9 41.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.009 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 87' ' ' VAL . 43.6 t -115.12 118.52 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.864 -178.101 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.9 p -121.2 178.57 4.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.869 -169.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 59.17 35.88 23.76 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.464 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.6 HD23 HG23 ' A' ' 4' ' ' ILE . 9.7 mt -71.79 123.64 23.08 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . 0.929 ' HB2' ' HA2' ' A' ' 2' ' ' GLY . . . -60.93 -49.81 75.93 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.143 0.496 . . . . 0.0 110.922 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.6 t -126.88 134.7 50.43 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 170.429 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -123.56 142.96 50.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.322 0.582 . . . . 0.0 111.703 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -155.43 -85.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.76 -1.109 . . . . 0.0 108.859 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' THR . . . . . 0.571 HG22 ' HA ' ' A' ' 56' ' ' MET . 7.4 p -108.92 89.93 3.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.5 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.565 HD21 ' HB ' ' A' ' 28' ' ' VAL . 48.1 tp -95.3 147.86 23.04 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.405 ' H ' HD12 ' A' ' 37' ' ' LEU . 9.9 t30 -133.4 146.18 50.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.385 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ILE . . . . . 0.509 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.2 mm -120.08 134.41 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 m -129.32 133.84 47.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.041 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TRP . . . . . 0.584 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 79.6 m95 -111.77 146.59 37.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.23 174.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.07 164.39 38.1 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.927 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.4 t -73.8 167.17 21.96 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 84' ' ' VAL . 35.9 tt0 -59.78 -31.22 69.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.008 0.432 . . . . 0.0 110.841 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.427 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 18.4 m -75.11 -6.81 51.52 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.35 19.69 37.77 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.295 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 6.6 mm-40 -81.77 122.42 80.25 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 23.3 Cg_exo -62.38 135.8 55.85 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.546 2.164 . . . . 0.0 113.352 -172.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 49' ' ' LEU . 7.6 mt -105.91 148.36 27.71 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.217 177.353 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.65 106.33 2.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.419 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' THR . . . . . 0.428 HG22 HD11 ' A' ' 53' ' ' ILE . 18.1 m -144.06 114.32 7.45 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.824 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -115.99 120.15 38.2 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.116 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.428 HD11 HG22 ' A' ' 51' ' ' THR . 5.2 mp -135.35 119.72 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.061 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -128.18 105.3 8.27 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.936 176.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -156.76 147.91 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.357 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' MET . . . . . 0.571 ' HA ' HG22 ' A' ' 36' ' ' THR . 0.0 OUTLIER -107.27 8.38 29.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.944 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -131.57 151.19 51.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.739 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.3 m -81.54 165.25 21.33 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' HIS . . . . . 0.535 ' HB2' ' O ' ' A' ' 65' ' ' SER . 10.5 m-70 -91.33 133.72 30.98 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.89 0.376 . . . . 0.0 111.065 -172.416 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' PRO . . . . . 0.463 ' HB2' ' H ' ' A' ' 61' ' ' ASN . 94.6 Cg_endo -93.07 -145.43 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.596 2.864 . . . . 0.0 112.493 178.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASN . . . . . 0.463 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 93.1 m-20 70.9 50.86 0.32 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.331 177.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.54 -0.58 46.15 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.515 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' THR . . . . . 0.755 HG23 ' H ' ' A' ' 65' ' ' SER . 2.7 t -153.28 170.87 19.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.903 0.382 . . . . 0.0 110.54 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -119.52 25.07 10.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.762 0.792 . . . . 0.0 109.203 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.755 ' H ' HG23 ' A' ' 63' ' ' THR . 5.5 m -110.77 172.48 6.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.622 -165.586 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.452 ' CB ' HD23 ' A' ' 37' ' ' LEU . . . -109.49 160.96 15.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.785 177.124 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.3 ttmt -130.59 139.11 50.41 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLY . . . . . 0.509 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -126.36 119.65 3.47 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.471 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 46.6 t -108.48 123.98 64.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.808 0.337 . . . . 0.0 110.818 -177.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.98 137.15 52.37 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.081 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.7 m -98.99 116.09 30.44 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.238 0.542 . . . . 0.0 110.144 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' VAL . . . . . 0.416 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.3 m -120.34 166.82 14.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.692 -177.091 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 m -75.95 134.19 40.27 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.6 p -53.02 -34.07 20.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.762 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -56.83 -40.81 76.71 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.456 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -67.24 -44.67 78.84 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.476 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -63.5 -42.01 98.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.824 176.643 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASN . . . . . 0.6 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 7.5 t30 -73.11 -11.71 60.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.988 -176.314 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -107.18 12.61 28.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 65.74 37.85 5.53 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.783 176.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -76.84 152.72 35.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.115 0.483 . . . . 0.0 111.545 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 42.6 mt-10 -109.35 138.82 45.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.252 177.15 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -125.37 151.92 45.47 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.02 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 88.2 t -116.54 129.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.38 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' CYS . . . . . 0.675 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 43.3 t -105.89 131.87 52.69 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' THR . . . . . 0.549 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -125.99 137.34 53.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -128.29 133.46 66.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.197 0.522 . . . . 0.0 112.139 -173.169 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -114.93 100.44 8.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.681 -177.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' HIS . . . . . 0.518 ' ND1' HD13 ' A' ' 37' ' ' LEU . 18.5 t60 -99.79 -11.03 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.696 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 50.0 ttt180 74.06 -24.05 0.21 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.045 0.538 . . . . 0.0 111.116 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 89' ' ' HIS . 39.0 t70 -71.97 -31.88 66.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.158 0.504 . . . . 0.0 110.46 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.78 152.22 42.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.747 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.29 -21.87 10.09 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.192 2.595 . . . . 0.0 113.249 -176.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 57.4 p -125.76 114.95 24.71 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.453 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' PRO . . . . . 0.549 ' HB2' HG22 ' A' ' 86' ' ' THR . 16.3 Cg_endo -58.25 141.87 97.02 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 111.228 176.92 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLN . . . . . 0.511 ' O ' ' HA ' ' A' ' 86' ' ' THR . 44.4 mt-30 -91.19 128.47 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.761 -173.24 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.675 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.6 ptmt -111.52 130.19 55.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.211 0.529 . . . . 0.0 110.827 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 68.1 mmtt -121.56 152.91 38.71 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.733 -177.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.5 130.48 55.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 10' ' ' PRO . 16.0 tt -126.84 144.12 38.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' SER . . . . . 0.556 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 29.5 t -156.77 151.0 25.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.503 -175.763 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 13.8 tmtt? . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.725 -0.655 . . . . 0.0 110.078 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 . . . . . 0 CA--C 1.513 -0.456 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.528 HG23 HD23 ' A' ' 31' ' ' LEU . 67.7 mt -75.67 122.2 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.119 0.485 . . . . 0.0 111.883 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.445 HD23 ' HE2' ' A' ' 7' ' ' PHE . 11.1 mp -103.97 131.57 51.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.276 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.463 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 6.7 t -124.42 127.64 47.84 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.521 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HE2' HD23 ' A' ' 5' ' ' LEU . 93.5 m-85 -138.0 148.7 45.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.52 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.7 p -112.35 141.57 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.738 0.304 . . . . 0.0 110.714 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.3 mm -117.15 122.74 30.82 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 121.114 0.483 . . . . 0.0 110.361 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.25 143.59 17.69 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.013 2.475 . . . . 0.0 111.754 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.68 141.84 38.58 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 121.988 1.792 . . . . 0.0 110.328 175.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.412 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.9 m -80.05 156.22 27.2 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.36 -174.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.99 -42.91 69.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.779 0.323 . . . . 0.0 110.266 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -61.68 -45.7 92.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.191 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -62.28 -44.47 96.45 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.972 0.415 . . . . 0.0 110.776 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 12' ' ' SER . 54.8 mt -65.52 -29.44 47.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.54 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -71.49 -39.71 70.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 20.7 mt -67.0 -48.41 68.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.093 -176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -89.52 -23.11 22.12 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.163 -175.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 64.04 19.22 11.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.963 -175.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.4 m -137.74 134.24 35.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.895 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.38 141.36 30.05 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 10.0 p30 -127.27 137.41 52.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.149 0.499 . . . . 0.0 109.899 -176.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 84.6 mt -95.86 126.52 41.18 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.687 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 m -120.05 132.47 55.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.835 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 39.7 t -123.1 137.39 54.93 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.73 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 27' ' ' LEU . 2.5 tm? -117.55 123.19 45.64 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 87' ' ' VAL . 22.7 t -122.56 119.63 58.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.036 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.2 t -137.15 178.75 6.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.611 -172.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 61.08 30.19 19.33 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.691 0.619 . . . . 0.0 111.742 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.528 HD23 HG23 ' A' ' 4' ' ' ILE . 44.3 mt -62.15 126.31 26.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.231 0 CA-C-O 121.336 0.589 . . . . 0.0 110.154 -179.772 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.4 m120 . . . . . 0 N--CA 1.45 -0.442 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.8 mm -120.95 137.13 55.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 25.4 m -130.12 130.03 44.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.764 0.316 . . . . 0.0 111.226 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 70.9 m95 -117.31 141.91 47.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.523 175.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.38 156.3 40.43 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.631 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.465 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 19.6 m -74.98 158.84 32.59 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -54.08 -30.85 49.9 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.047 0.451 . . . . 0.0 111.277 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -73.4 -1.56 18.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.96 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.84 21.37 47.02 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.073 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 37.9 mt-10 -99.95 122.04 52.07 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.6 Cg_exo -58.67 137.9 82.72 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.859 2.373 . . . . 0.0 112.385 -176.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' A' ' 49' ' ' LEU . 10.9 mt -103.51 146.55 28.36 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.99 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.79 105.87 0.5 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.227 175.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.9 m . . . . . 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.658 -176.594 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 N--CA 1.451 -0.383 0 CA-C-O 121.179 0.514 . . . . 0.0 111.644 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.52 151.65 27.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.476 171.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.4 mtmt -131.63 140.49 49.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.078 0.466 . . . . 0.0 110.153 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.488 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -117.19 125.92 6.73 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 174.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 54.2 t -108.63 120.84 60.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.818 0.342 . . . . 0.0 110.426 -178.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -114.46 140.17 48.93 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.895 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.3 m -99.39 115.03 28.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.152 0.501 . . . . 0.0 110.445 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -119.69 166.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.053 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.404 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 21.6 m -82.11 137.26 35.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.96 -28.54 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.917 177.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.42 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 23.6 mt-10 -56.99 -42.2 79.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.621 176.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 46.1 m-20 -63.08 -47.85 81.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 109.904 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.427 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -63.56 -39.0 93.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.328 177.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -69.45 -28.65 66.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.76 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -94.48 12.64 26.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 64.7 36.87 7.92 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.283 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.81 163.74 26.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.038 0.447 . . . . 0.0 110.539 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -130.71 139.34 50.29 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.595 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 83.9 m-85 -121.52 162.04 21.24 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.215 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 75.0 t -122.94 126.54 73.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.99 0.424 . . . . 0.0 111.073 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 48.5 t -106.4 136.89 45.36 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 173.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.477 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -124.36 129.57 50.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.767 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 28' ' ' VAL . 38.9 t -102.27 126.63 56.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.668 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.1 p -117.43 93.58 4.22 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.473 0.654 . . . . 0.0 110.673 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.534 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 74.8 t60 -99.46 -7.13 26.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.181 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 89' ' ' HIS . 37.6 ptt85 65.08 -11.79 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.476 1.51 . . . . 0.0 112.537 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.534 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 16.0 t70 -76.27 -33.95 59.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.467 0.651 . . . . 0.0 110.304 -174.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.89 153.68 37.73 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.564 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.23 -23.63 11.67 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.083 2.522 . . . . 0.0 112.55 -178.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.487 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 15.9 m -132.02 114.78 15.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.917 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.487 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 14.3 Cg_endo -56.84 141.15 92.88 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.933 2.422 . . . . 0.0 111.913 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -89.65 127.1 35.87 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.458 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.9 ptpt -108.22 140.76 40.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.359 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 6' ' ' THR . 62.3 mmtt -127.37 139.97 52.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.978 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -101.67 136.99 40.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.709 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 tt -131.38 138.87 52.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.866 0.365 . . . . 0.0 110.956 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.6 t -154.53 149.99 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.581 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.427 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 53.4 tttm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.452 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 . . . . . 0 CA--C 1.519 -0.239 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 31' ' ' LEU . 54.4 mt -60.28 126.93 18.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.36 130.92 52.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.164 0.507 . . . . 0.0 110.673 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -112.56 119.46 38.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.066 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.574 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 58.1 m-85 -119.77 135.37 54.87 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.722 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.4 p -113.67 132.43 55.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.818 0.342 . . . . 0.0 110.533 177.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.64 124.79 28.58 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.189 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.31 140.44 58.5 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.775 2.317 . . . . 0.0 111.518 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HB2' HD11 ' A' ' 16' ' ' ILE . 18.2 Cg_endo -59.05 162.03 14.59 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.271 2.647 . . . . 0.0 113.071 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.507 ' O ' HG13 ' A' ' 16' ' ' ILE . 40.7 t -78.73 114.24 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.351 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.548 ' HA ' HD12 ' A' ' 16' ' ' ILE . 32.7 t80 -56.7 -35.32 68.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.568 -171.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -44.76 70.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.992 0.425 . . . . 0.0 111.049 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.56 -33.67 76.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.03 -176.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.8 mt -57.85 -40.19 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.909 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -72.36 -39.33 68.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.465 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.14 -48.01 59.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.448 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.7 m -78.26 -12.82 60.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.969 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp 66.24 7.88 5.18 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.046 -176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.9 m -138.41 134.69 34.43 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.993 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.679 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -80.57 165.4 22.13 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.688 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.444 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 25.2 m120 -139.76 151.79 46.08 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.708 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 80.9 mt -114.01 119.69 38.05 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.211 -177.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.7 m -105.02 123.42 47.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.311 0.577 . . . . 0.0 111.312 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.5 ' HG ' ' HG ' ' A' ' 85' ' ' CYS . 42.2 t -109.83 137.06 48.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.267 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 1.3 tm? -127.5 122.55 33.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.14 120.95 54.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.744 0.306 . . . . 0.0 110.561 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 t -137.93 178.09 7.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.448 -175.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 59.14 42.01 19.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.564 0.54 . . . . 0.0 112.182 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 4' ' ' ILE . 16.3 mt -71.9 124.06 24.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 175.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.423 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . . . . . . 0 CA--C 1.52 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.41 -178.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 . . . . . 0 N--CA 1.45 -0.453 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.532 HG21 ' HA3' ' A' ' 68' ' ' GLY . 30.4 mm -119.79 137.31 54.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 176.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' THR . 22.6 t -143.28 138.75 29.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.045 -0.662 . . . . 0.0 111.457 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.512 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 86.3 m95 -126.22 143.23 51.22 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.605 177.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.39 160.4 43.46 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.487 ' HB2' ' OE1' ' A' ' 47' ' ' GLU . 18.7 m -87.59 160.13 18.3 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -54.36 -37.32 64.81 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.424 ' HB3' ' OE1' ' A' ' 47' ' ' GLU . 10.6 t -85.59 6.61 26.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.016 0.436 . . . . 0.0 110.995 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.93 23.59 24.96 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.547 173.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.487 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 3.2 mp0 -84.51 122.12 75.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.6 136.73 64.69 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.419 2.079 . . . . 0.0 111.72 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -113.68 139.78 48.78 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.645 -176.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.55 106.66 2.23 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.895 177.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 8.9 m . . . . . 0 C--N 1.317 -0.815 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.931 -176.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 p . . . . . 0 C--O 1.24 0.553 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.74 145.27 32.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.184 167.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -131.21 138.25 49.29 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.98 0.419 . . . . 0.0 110.072 -176.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.532 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -146.89 136.72 6.3 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 176.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.708 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 5.6 m -116.95 149.94 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 117.319 0.559 . . . . 0.0 111.342 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 51' ' ' THR . . . -114.59 150.39 35.09 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.427 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -98.33 114.73 27.15 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 122.105 0.955 . . . . 0.0 110.063 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.1 t -119.41 153.36 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.628 0 CA-C-N 113.401 -1.727 . . . . 0.0 109.383 -173.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -83.98 141.1 31.46 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.5 p -53.16 -33.13 19.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-O 121.057 0.456 . . . . 0.0 109.901 176.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -55.62 -36.64 67.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.423 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -68.15 -51.91 40.62 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.122 0.487 . . . . 0.0 109.974 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.478 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -66.73 -34.96 79.0 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.515 -177.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 32.3 t30 -71.73 -22.16 61.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.71 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -101.33 8.88 42.14 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.829 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 64.99 37.91 6.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.25 151.1 13.21 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.48 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -109.06 138.11 45.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.448 172.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.478 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.1 m-85 -127.6 156.05 42.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.162 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.533 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.5 t -119.17 127.37 75.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.608 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.512 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 49.9 t -105.47 130.94 53.44 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.547 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -125.54 122.41 36.45 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.0 t -108.55 127.37 65.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.769 0.319 . . . . 0.0 111.004 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.487 HG22 ' HB3' ' A' ' 95' ' ' PRO . 23.3 p -122.16 108.82 13.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.102 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.498 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 84.9 t60 -98.43 -50.99 4.11 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.977 -176.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 37.6 ttt-85 128.55 -20.5 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 O-C-N 125.178 1.549 . . . . 0.0 107.735 -163.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.557 ' HB3' HD11 ' A' ' 4' ' ' ILE . 12.2 t70 -73.32 -37.32 66.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.314 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.15 152.14 75.45 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.281 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.32 -23.33 13.38 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.433 2.755 . . . . 0.0 112.86 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 36.7 m -125.59 109.93 25.78 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.547 ' HB2' HG22 ' A' ' 86' ' ' THR . 14.1 Cg_endo -56.8 142.11 92.31 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 123.026 2.484 . . . . 0.0 112.528 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 86' ' ' THR . 41.3 mt-30 -80.94 131.37 35.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.161 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -109.46 127.89 54.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.303 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 57.6 mmtt -122.64 133.74 54.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -178.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.0 m-85 -100.91 132.71 46.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 13.7 tt -126.63 139.02 52.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.099 0.476 . . . . 0.0 111.255 -178.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.1 p -158.02 149.45 21.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.613 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.874 178.672 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 30' ' ' ASN . 33.1 t70 . . . . . 0 CA--C 1.516 -0.348 0 CA-C-O 120.748 0.309 . . . . 0.0 110.426 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 31' ' ' LEU . 66.2 mt -63.13 124.38 17.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.933 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.76 130.81 49.85 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.222 0.534 . . . . 0.0 109.877 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.7 m -114.66 118.29 33.25 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.005 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.69 142.68 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.176 0.513 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -119.29 131.61 55.78 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.122 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 37.1 mm -117.88 124.97 28.34 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.302 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 33.6 Cg_endo -64.35 143.64 83.47 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 122.738 2.292 . . . . 0.0 111.798 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.571 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 44.8 Cg_endo -65.77 152.12 82.49 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.674 2.249 . . . . 0.0 111.825 178.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.477 ' O ' HG13 ' A' ' 16' ' ' ILE . 34.3 t -78.23 124.29 27.91 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.645 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.36 -29.55 69.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.409 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.39 77.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.216 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.9 -45.83 76.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.19 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 22' ' ' ALA . 73.2 mt -56.99 -33.09 41.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 121.147 0.499 . . . . 0.0 110.693 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -66.46 -43.77 84.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -76.98 -49.38 15.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.543 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 m -74.14 -19.51 60.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.915 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt 67.44 7.11 5.33 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.249 0.619 . . . . 0.0 111.198 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.7 t -139.17 153.56 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.501 -0.772 . . . . 0.0 108.952 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.551 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -93.67 142.67 27.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.587 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 42.5 m-80 -131.19 112.42 12.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.12 0.486 . . . . 0.0 110.458 -173.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.7 mt -78.74 143.36 36.25 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.941 -177.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.483 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 28.0 m -125.59 123.0 38.08 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.336 0.588 . . . . 0.0 110.758 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 36.6 t -114.15 131.96 56.25 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.445 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.557 HD23 ' HE3' ' A' ' 67' ' ' LYS . 3.2 tm? -118.91 124.67 47.65 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.54 ' O ' ' HB3' ' A' ' 65' ' ' SER . 14.5 t -120.18 119.74 60.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.5 t -134.04 177.63 7.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.673 -173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 1.1 t30 58.5 45.93 15.72 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.558 0.536 . . . . 0.0 111.447 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.646 HD13 ' HE1' ' A' ' 89' ' ' HIS . 17.7 mt -71.48 146.36 48.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.209 -175.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.327 -0.393 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.502 -171.206 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.409 HD22 ' HA ' ' A' ' 38' ' ' ASN . 6.0 m120 . . . . . 0 N--CA 1.455 -0.208 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.608 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.0 mm -120.19 136.83 55.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.4 t -137.3 131.59 32.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.97 0.414 . . . . 0.0 110.382 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.512 ' HD1' HG21 ' A' ' 51' ' ' THR . 62.3 m95 -112.8 149.91 32.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.27 163.71 39.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.178 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 31.9 t -88.13 171.84 9.95 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.835 175.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -55.48 -29.94 59.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.137 0.494 . . . . 0.0 111.367 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -73.53 -8.62 56.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.922 0.392 . . . . 0.0 111.108 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.66 16.08 55.52 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.456 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 12.5 pt-20 -94.31 126.97 46.27 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -174.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.26 135.46 62.0 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.012 2.475 . . . . 0.0 113.565 -172.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.497 HD11 ' CD1' ' A' ' 83' ' ' PHE . 9.8 mt -97.37 147.8 23.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.02 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.69 106.51 3.55 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.886 0.851 . . . . 0.0 110.177 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.512 HG21 ' HD1' ' A' ' 41' ' ' TRP . 16.5 m . . . . . 0 C--N 1.31 -1.116 0 CA-C-N 113.908 -1.496 . . . . 0.0 109.382 -175.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.54 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 14.6 m . . . . . 0 N--CA 1.449 -0.49 0 CA-C-O 121.273 0.559 . . . . 0.0 111.566 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.99 143.16 35.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 175.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.557 ' HE3' HD23 ' A' ' 27' ' ' LEU . 56.7 mttp -129.74 139.92 51.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.608 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -124.88 123.97 5.22 Favored Glycine 0 N--CA 1.44 -1.075 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 62.0 t -106.93 123.33 61.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.979 0.418 . . . . 0.0 109.971 -177.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.587 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -113.46 136.12 53.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.063 -177.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 p -98.16 113.54 25.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.493 -177.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.509 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m -119.47 164.44 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.155 -175.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.477 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 42.5 m -74.99 140.67 43.79 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.451 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -61.54 -32.22 52.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.551 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 5.5 mm-40 -60.22 -33.94 72.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.229 177.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.477 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 4.7 m-20 -62.16 -44.81 95.78 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -74.31 -34.85 63.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.435 -179.733 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.441 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 82.7 m-20 -64.29 -32.54 74.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.756 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -92.56 6.65 46.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.928 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 58.33 38.25 25.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -66.05 166.09 12.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.406 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 101' ' ' SER . 26.6 tt0 -123.27 139.19 54.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.084 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.497 ' CD1' HD11 ' A' ' 49' ' ' LEU . 79.2 m-85 -121.81 163.75 18.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.341 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.467 HG22 ' CD1' ' A' ' 99' ' ' PHE . 89.3 t -128.42 128.08 67.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.474 -176.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.737 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 25.9 p -105.89 142.81 34.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.544 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -123.53 127.31 48.15 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.485 HG11 HG11 ' A' ' 28' ' ' VAL . 60.3 t -106.47 127.26 61.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.079 -177.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -126.84 102.28 6.96 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.318 0.58 . . . . 0.0 109.493 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.761 ' HD2' ' HB2' ' A' ' 91' ' ' ASP . 40.9 t60 -98.52 -9.99 24.16 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.04 -174.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER 71.07 11.43 6.95 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.831 0.824 . . . . 0.0 109.042 -174.306 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.761 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 7.0 t70 -92.66 -37.25 12.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.5 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -122.63 155.57 62.71 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.733 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.43 -31.79 10.87 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.811 2.341 . . . . 0.0 112.551 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 92' ' ' LEU . 22.2 p -113.04 110.25 51.57 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.63 -177.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.544 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.5 Cg_endo -62.64 141.79 87.15 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.765 2.31 . . . . 0.0 111.892 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.15 136.16 34.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.45 -176.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -107.22 132.61 52.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.212 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.737 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -124.95 140.86 52.54 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.725 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.467 ' CD1' HG22 ' A' ' 84' ' ' VAL . 70.3 m-85 -104.83 141.08 37.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.142 -177.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.4 tt -140.5 137.32 36.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.805 0.336 . . . . 0.0 110.602 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 22.8 t -157.89 150.33 22.46 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 1.1 tmmt? . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.336 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 . . . . . 0 CA--C 1.516 -0.334 0 CA-C-O 121.378 0.608 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.531 HG23 HD23 ' A' ' 31' ' ' LEU . 81.9 mt -60.32 122.29 10.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.792 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.6 mt -107.63 132.2 53.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.145 0.497 . . . . 0.0 110.877 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.483 HG22 HG21 ' A' ' 87' ' ' VAL . 33.4 p -107.66 127.11 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.268 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -124.73 152.8 43.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.709 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.0 p -134.12 138.29 45.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.574 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -117.9 123.06 29.93 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.606 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.487 ' HA ' HD11 ' A' ' 100' ' ' ILE . 72.1 Cg_endo -75.32 140.15 24.27 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.129 2.552 . . . . 0.0 111.819 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HG2' HD11 ' A' ' 16' ' ' ILE . 73.7 Cg_endo -70.86 150.56 61.69 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.289 1.993 . . . . 0.0 111.754 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -78.73 144.7 34.99 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.114 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.39 -31.33 71.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.089 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.03 93.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.312 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.68 -47.24 84.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.974 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.407 HD11 ' HG2' ' A' ' 11' ' ' PRO . 57.6 mt -63.35 -34.14 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.497 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -73.28 -45.69 54.23 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.758 -175.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.0 -49.37 37.59 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.669 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.8 m -80.38 -15.83 55.91 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.158 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.8 mttp 62.16 19.6 11.04 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.299 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.7 m -141.09 154.72 46.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.372 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.764 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -104.53 162.39 13.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -146.84 145.91 30.03 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.559 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 69.4 mt -107.17 128.01 54.02 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.233 -177.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.7 m -115.54 126.8 54.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.163 0.506 . . . . 0.0 111.098 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.671 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 32.7 t -126.62 138.45 53.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.525 HD12 ' HG2' ' A' ' 67' ' ' LYS . 2.5 tt -132.34 135.82 46.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.235 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' SER . 42.1 t -118.18 125.59 74.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.372 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.4 m -127.94 176.38 7.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.295 -176.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 59.66 41.34 18.79 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.101 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 HG23 ' A' ' 4' ' ' ILE . 34.7 mt -80.49 126.85 31.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.549 177.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.213 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.634 -178.149 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.8 m120 . . . . . 0 N--CA 1.446 -0.66 0 N-CA-C 110.027 -0.36 . . . . 0.0 110.027 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.505 HG21 ' HA3' ' A' ' 68' ' ' GLY . 20.6 mm -119.36 134.97 61.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 172.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.7 t -143.34 126.99 17.0 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.069 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 87.7 m95 -105.15 148.35 26.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.2 0.524 . . . . 0.0 110.382 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.56 158.23 40.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.507 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.41 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 32.3 t -75.68 162.58 28.11 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -58.09 -25.16 60.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.258 0.551 . . . . 0.0 110.296 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.3 m -72.95 -8.56 56.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.133 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.17 19.2 43.3 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.283 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -100.03 123.57 46.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.516 0.198 . . . . 0.0 110.868 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.08 141.69 96.77 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.317 2.678 . . . . 0.0 113.276 -176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.9 mt -113.21 147.38 37.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.168 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 21.9 tt0 -56.78 107.52 0.4 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.587 176.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.2 m . . . . . 0 C--N 1.316 -0.872 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.299 178.742 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.45 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 2.0 m . . . . . 0 N--CA 1.446 -0.647 0 CA-C-O 121.486 0.66 . . . . 0.0 111.975 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -108.27 149.3 28.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.071 174.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.525 ' HG2' HD12 ' A' ' 27' ' ' LEU . 28.9 mtpp -131.69 139.37 49.02 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.36 129.2 4.61 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.926 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 42.1 t -115.23 132.06 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.788 0.328 . . . . 0.0 110.714 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.32 151.65 35.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.167 177.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -99.33 120.74 40.06 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.592 0.71 . . . . 0.0 110.38 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.764 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.0 t -124.25 151.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.083 -174.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -88.57 153.27 21.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -60.87 -36.75 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.191 0.52 . . . . 0.0 109.98 -177.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 9.9 mm-40 -57.54 -33.88 68.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.778 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.21 -48.33 80.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.535 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -68.78 -36.24 78.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.756 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 87.6 m-20 -64.24 -34.35 77.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.974 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -87.53 7.12 30.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.666 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 80' ' ' ARG . 23.2 mmt180 56.58 37.81 29.11 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.76 178.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -63.5 159.08 19.31 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.651 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -111.63 138.07 48.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.842 175.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.41 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 68.5 m-85 -122.42 154.26 37.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.29 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.511 HG22 ' CD1' ' A' ' 99' ' ' PHE . 86.2 t -123.59 128.19 74.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -173.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 28.9 p -106.15 140.27 39.38 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.477 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -119.19 127.02 52.91 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.773 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.483 HG21 HG22 ' A' ' 6' ' ' THR . 58.6 t -110.26 133.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.817 -178.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.0 p -139.06 100.67 4.09 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.176 0.512 . . . . 0.0 111.066 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.521 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 50.2 t60 -98.4 -8.19 27.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.03 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 52.2 ttt180 79.7 -27.6 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.782 0.676 . . . . 0.0 110.738 -176.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -71.17 -33.11 69.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.087 0.47 . . . . 0.0 110.75 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.44 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.9 OUTLIER -87.89 146.44 38.78 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-O 121.203 0.525 . . . . 0.0 110.752 177.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.62 -19.54 11.31 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.288 2.658 . . . . 0.0 112.813 -175.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 20.1 m -141.25 132.52 13.53 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.555 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 27.3 Cg_exo -61.85 140.99 88.38 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.497 2.131 . . . . 0.0 111.514 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -92.75 128.56 38.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.903 0.382 . . . . 0.0 110.456 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.477 ' HG2' HG23 ' A' ' 86' ' ' THR . 56.5 mtpt -106.11 141.62 37.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.679 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 30.3 mmtm -129.85 138.98 51.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.292 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.511 ' CD1' HG22 ' A' ' 84' ' ' VAL . 15.7 m-30 -100.98 137.56 39.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.86 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.6 tt -130.48 139.45 51.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.958 0.409 . . . . 0.0 110.722 177.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.5 p -157.38 148.7 21.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.219 176.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.463 ' HB2' ' NE1' ' A' ' 77' ' ' TRP . 27.1 tptp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.687 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 CA--C 1.518 -0.258 0 CA-C-O 121.152 0.501 . . . . 0.0 111.664 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.581 HG23 HD23 ' A' ' 31' ' ' LEU . 84.0 mt -63.29 135.95 26.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.437 174.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.6 mt -104.54 130.79 52.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.929 0.395 . . . . 0.0 110.29 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.0 p -116.86 122.57 44.74 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.14 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -121.1 133.92 55.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.48 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 p -112.14 134.48 53.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.22 176.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.51 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 34.0 mm -117.42 119.93 33.89 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.574 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.51 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 18.1 Cg_endo -58.31 139.59 91.12 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.996 2.464 . . . . 0.0 111.802 173.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.523 ' HB2' HD11 ' A' ' 16' ' ' ILE . 43.6 Cg_endo -65.96 153.14 79.34 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 123.118 2.546 . . . . 0.0 112.905 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.499 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.0 t -81.09 121.41 26.06 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 178.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' A' ' 16' ' ' ILE . 51.8 t80 -62.83 -34.08 76.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.105 -173.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.413 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -61.98 -46.41 89.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.449 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.25 -38.86 88.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.568 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.585 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.6 mt -58.9 -40.68 80.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.52 176.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -73.6 -43.56 59.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.073 -176.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -62.86 -48.71 77.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.952 -177.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.2 p -86.94 -13.95 43.22 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.176 0.512 . . . . 0.0 111.07 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.81 27.06 16.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.049 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.4 m -139.08 134.0 32.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.144 174.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.585 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -87.51 142.65 27.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 39.2 m-80 -126.55 118.41 24.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.009 0.433 . . . . 0.0 110.091 -173.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.546 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 86.9 mt -82.82 139.15 33.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.959 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 30.2 m -124.9 120.62 32.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.477 0.656 . . . . 0.0 110.937 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 42.5 t -121.48 136.67 54.94 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.413 178.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HG ' ' OG ' ' A' ' 65' ' ' SER . 2.7 tt -131.81 130.75 42.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.531 HG11 HG21 ' A' ' 87' ' ' VAL . 12.8 t -120.76 119.5 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.687 -176.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.1 p -130.86 177.13 7.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.043 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.2 45.28 17.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.298 0.57 . . . . 0.0 111.189 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.581 HD23 HG23 ' A' ' 4' ' ' ILE . 25.4 mt -78.16 110.5 13.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.352 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.325 -0.491 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.407 -172.426 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.5 m120 . . . . . 0 N--CA 1.441 -0.912 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.646 HG21 ' HA3' ' A' ' 68' ' ' GLY . 16.0 mm -119.21 134.79 61.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 175.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.411 ' HB3' ' O ' ' A' ' 86' ' ' THR . 23.2 t -141.26 129.89 22.75 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 119.666 -0.814 . . . . 0.0 111.508 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.579 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -105.48 146.88 28.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.687 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.51 164.19 38.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.701 179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.8 p -75.52 170.6 15.82 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -58.45 -28.51 65.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.139 0.495 . . . . 0.0 110.818 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.0 m -75.62 -8.21 56.22 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.219 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.7 21.43 43.49 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.347 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 0.8 OUTLIER -96.64 122.9 55.88 Favored Pre-proline 0 N--CA 1.443 -0.775 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 38.1 Cg_exo -59.78 139.63 89.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 123.024 2.483 . . . . 0.0 113.875 -172.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 7.1 mt -105.74 145.02 31.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.604 174.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -63.12 105.8 0.76 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.335 0.588 . . . . 0.0 110.325 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.42 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.2 m . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.269 -176.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.483 ' OG ' ' HG ' ' A' ' 27' ' ' LEU . 33.0 t . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 120.79 0.328 . . . . 0.0 111.193 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.431 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.66 155.74 21.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.482 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.417 ' HG2' HD12 ' A' ' 27' ' ' LEU . 46.7 mttp -129.72 139.44 51.33 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 176.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.646 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -121.93 118.76 3.8 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.546 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 58.5 t -107.84 122.95 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.748 0.308 . . . . 0.0 110.451 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.33 141.06 48.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.902 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -98.87 114.6 27.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.28 0.562 . . . . 0.0 110.326 -177.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.5 m -119.73 166.77 13.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.774 -177.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.4 m -79.13 144.89 34.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.905 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 t -57.24 -30.85 36.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 173.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.96 -39.58 90.1 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.473 177.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -61.81 -42.35 98.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.558 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -73.02 -39.19 66.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 179.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -68.9 -23.95 64.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.639 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -98.02 16.8 19.97 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 17.4 mmt180 55.59 36.71 27.72 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.969 173.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -71.98 157.59 37.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.373 0.606 . . . . 0.0 111.958 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.558 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.4 mp0 -109.23 139.11 44.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.433 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.37 151.81 45.62 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.219 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.9 t -122.2 122.74 67.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.399 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 20.6 p -105.6 133.37 50.45 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.548 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -126.4 128.38 46.93 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -178.076 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 HG11 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -119.84 127.41 75.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.039 0.447 . . . . 0.0 112.155 -174.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.0 m -112.18 108.51 17.79 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.191 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -101.21 -8.81 21.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.091 177.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 13.0 ttt180 74.15 -3.84 2.43 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.333 0.587 . . . . 0.0 110.317 -175.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.548 ' HB3' HD11 ' A' ' 4' ' ' ILE . 5.5 t70 -73.23 -36.32 66.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.569 -177.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -122.61 154.16 63.12 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.577 -176.563 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -68.08 -20.69 43.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.254 2.636 . . . . 0.0 112.476 -176.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.505 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 13.7 m -129.04 111.37 18.4 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.259 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.548 ' HB2' HG22 ' A' ' 86' ' ' THR . 11.8 Cg_endo -55.21 148.45 49.76 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.722 2.281 . . . . 0.0 110.919 174.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' THR . 40.9 mt-30 -90.8 127.42 36.34 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.759 -171.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 15.9 ptmt -110.14 129.92 55.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.304 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.726 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 67.6 mmtt -122.92 140.9 52.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.686 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -100.68 122.99 44.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.368 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.9 tt -122.86 139.29 50.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 3.7 p -157.47 148.87 21.82 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.245 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 49.5 tttp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.098 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 . . . . . 0 CA--C 1.517 -0.322 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.468 HG23 HD23 ' A' ' 31' ' ' LEU . 59.6 mt -66.95 120.5 14.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.391 0.432 . . . . 0.0 110.237 -176.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.5 mt -108.77 134.41 51.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.17 0.509 . . . . 0.0 111.192 -175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.513 ' HB ' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -107.39 127.72 53.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.112 -177.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . 0.54 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 94.9 m-85 -127.34 143.15 51.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -119.63 137.86 53.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.742 0.306 . . . . 0.0 110.664 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.17 123.46 30.05 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.995 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HA ' HD11 ' A' ' 100' ' ' ILE . 61.1 Cg_endo -70.91 148.73 58.22 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 123.124 2.549 . . . . 0.0 112.066 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.25 149.33 81.38 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.585 2.19 . . . . 0.0 111.75 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 16' ' ' ILE . 2.8 t -103.27 143.99 31.93 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -58.23 -30.59 66.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.458 -172.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -67.75 -44.18 78.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.782 0.325 . . . . 0.0 110.314 175.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.82 -45.95 91.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.16 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 12' ' ' SER . 51.9 mt -61.01 -29.89 46.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.363 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.95 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -72.3 -43.92 63.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.109 0.48 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.3 mm? -67.27 -49.53 63.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.262 -176.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 p -93.82 0.84 56.46 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 87.2 tttt 69.51 -48.9 0.61 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.4 0.68 . . . . 0.0 111.165 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 13.8 m -89.38 151.21 22.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.916 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.3 155.88 24.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.209 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -129.86 126.41 37.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.064 0.459 . . . . 0.0 110.588 -176.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.412 HD22 HD13 ' A' ' 100' ' ' ILE . 52.7 mt -89.39 138.45 31.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.81 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.559 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 19.2 m -120.8 129.2 53.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.018 0.437 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 47.0 t -109.75 137.38 47.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.169 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 2.8 tm? -126.34 123.73 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 87' ' ' VAL . 15.4 t -123.89 119.63 57.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.9 p -133.71 177.39 7.75 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -173.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 59.46 40.74 20.32 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.428 177.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.468 HD23 HG23 ' A' ' 4' ' ' ILE . 58.6 mt -64.1 127.43 31.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.187 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.23 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.651 -179.326 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 . . . . . 0 N--CA 1.45 -0.443 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.511 HG21 ' HA3' ' A' ' 68' ' ' GLY . 27.8 mm -121.86 151.91 25.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -177.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 37.3 m -149.98 123.74 9.23 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.084 -0.385 . . . . 0.0 111.109 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 67.4 m95 -107.76 144.87 34.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.174 0.512 . . . . 0.0 111.246 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.76 157.07 34.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.067 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.679 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 14.7 m -88.26 162.65 16.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.046 0.45 . . . . 0.0 109.926 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.3 -25.05 8.52 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.891 -1.05 . . . . 0.0 113.821 -170.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -88.1 -0.78 57.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.857 0.361 . . . . 0.0 111.403 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.16 22.16 28.18 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.324 -0.465 . . . . 0.0 112.061 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.679 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 8.2 pt-20 -100.4 128.76 29.51 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.731 0.301 . . . . 0.0 110.595 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 35.7 Cg_exo -61.13 141.55 94.08 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.33 2.687 . . . . 0.0 113.77 -173.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.502 HD11 ' CD1' ' A' ' 83' ' ' PHE . 8.5 mt -108.19 147.71 30.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.959 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 4.2 mp0 -62.39 106.2 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.632 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.5 m . . . . . 0 C--N 1.321 -0.637 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.801 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.567 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 17.3 m . . . . . 0 CA--C 1.533 0.308 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.69 146.0 31.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.861 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 55.6 mtpt -132.48 140.76 48.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.462 -175.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.511 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -129.33 139.37 10.91 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 53.6 t -114.44 124.5 71.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.0 0.429 . . . . 0.0 110.79 -174.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -115.69 134.64 54.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.83 177.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.8 m -98.92 123.38 43.16 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.081 0.467 . . . . 0.0 110.166 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' SER . 4.0 m -122.03 165.32 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.929 -175.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.1 t -86.69 150.06 24.45 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 t -63.82 -24.28 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -65.14 -36.53 84.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.731 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.451 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 59.7 m-20 -68.18 -44.67 75.4 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.442 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -69.18 -35.28 76.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.478 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -70.54 -27.7 64.35 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.587 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -92.94 7.67 43.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.918 0.39 . . . . 0.0 110.326 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.9 mtt-85 58.34 37.49 25.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.28 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 53.3 mtpt -67.1 156.48 36.03 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.977 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.51 139.23 43.55 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.273 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.502 ' CD1' HD11 ' A' ' 49' ' ' LEU . 64.8 m-85 -124.71 150.62 45.98 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.128 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 94.7 t -125.27 131.47 72.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.752 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 30.6 p -106.31 126.28 52.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.569 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 1.4 p -112.05 137.64 49.81 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.658 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 28' ' ' VAL . 44.7 t -116.59 127.42 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.603 -175.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 95' ' ' PRO . 1.4 p -119.02 94.22 4.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.692 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 1.3 t60 -85.34 -50.78 7.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.33 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.692 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 3.2 tmm_? 151.69 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.758 1.286 . . . . 0.0 108.307 -176.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -71.37 -30.41 66.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.662 -1.154 . . . . 0.0 112.177 -167.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.32 148.23 43.41 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-O 121.105 0.479 . . . . 0.0 111.067 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -78.61 -26.86 5.47 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.271 2.647 . . . . 0.0 111.96 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.6 p -118.39 122.3 30.28 Favored Pre-proline 0 N--CA 1.445 -0.684 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.518 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.569 ' HB2' ' HB ' ' A' ' 86' ' ' THR . 18.7 Cg_endo -60.5 140.72 92.83 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.198 1.932 . . . . 0.0 111.997 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.544 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.9 pt20 -78.94 135.11 36.86 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -113.31 128.01 56.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.315 0.579 . . . . 0.0 111.782 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.513 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 6.2 tmtt? -121.98 140.91 51.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.178 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -100.35 147.55 25.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.836 0.35 . . . . 0.0 111.101 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.6 tt -133.77 138.55 50.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.455 176.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 56.9 p -158.3 149.94 21.34 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.65 -0.69 . . . . 0.0 110.26 179.254 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 . . . . . 0 CA--C 1.517 -0.302 0 CA-C-O 120.689 0.281 . . . . 0.0 110.678 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.54 HG23 HD23 ' A' ' 31' ' ' LEU . 69.3 mt -60.39 121.81 9.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.308 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 83.4 mt -108.95 140.32 42.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.003 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.528 ' HB ' HG21 ' A' ' 87' ' ' VAL . 2.5 t -134.21 125.41 27.76 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.202 0.525 . . . . 0.0 110.517 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -121.52 141.9 50.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.483 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.465 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.7 p -113.55 132.44 55.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.012 0.434 . . . . 0.0 111.48 -178.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.44 124.34 29.07 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.089 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -77.91 145.0 22.08 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 123.153 2.569 . . . . 0.0 112.267 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.0 147.76 49.72 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 122.453 2.102 . . . . 0.0 111.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.91 155.17 16.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.096 -176.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -56.47 -43.97 80.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.555 0.217 . . . . 0.0 111.487 -173.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -45.89 92.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.149 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.22 -40.06 95.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.045 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.36 -30.58 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.704 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -71.85 -43.96 64.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.853 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.45 -48.15 61.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.734 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.5 p -80.91 -13.09 59.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.54 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 60.16 21.26 10.56 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.865 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.3 m -137.82 137.75 38.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.349 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.534 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -97.12 148.91 22.56 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.4 p30 -157.73 127.73 6.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.001 0.429 . . . . 0.0 110.484 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.524 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -84.41 146.94 27.39 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.063 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.7 m -124.22 120.97 33.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.169 0.509 . . . . 0.0 111.154 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.576 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.4 t -113.27 137.69 51.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' A' ' 67' ' ' LYS . 1.2 tt -131.9 138.08 48.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.854 0.359 . . . . 0.0 110.629 175.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.622 HG22 ' H ' ' A' ' 66' ' ' ALA . 4.4 m -115.03 147.1 18.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.539 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 7.3 p -143.19 175.25 10.02 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.708 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 59.1 31.99 21.77 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.54 HD23 HG23 ' A' ' 4' ' ' ILE . 49.5 mt -71.34 118.36 14.04 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 -0.111 0 CA-C-O 121.163 0.506 . . . . 0.0 110.573 -179.557 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.446 -0.661 0 N-CA-C 109.627 -0.509 . . . . 0.0 109.627 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.644 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.1 mm -120.87 135.23 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 t -138.73 147.46 42.72 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -123.7 149.3 45.67 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.372 177.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -147.07 150.93 36.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 m -74.73 150.6 39.38 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.58 HE22 ' HD1' ' A' ' 99' ' ' PHE . 8.8 tp-100 -52.59 -24.7 8.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.6 p -73.5 -6.72 48.23 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.175 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.24 19.92 37.39 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.99 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.4 mt-10 -100.02 121.5 53.74 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 24.3 Cg_exo -63.55 139.6 71.01 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.826 2.351 . . . . 0.0 112.93 -175.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.5 mt -107.07 145.43 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.596 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -72.0 106.85 4.44 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.929 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 m . . . . . 0 C--N 1.319 -0.735 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.44 -176.334 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 32.7 t . . . . . 0 N--CA 1.448 -0.563 0 CA-C-O 120.977 0.418 . . . . 0.0 111.963 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.622 ' H ' HG22 ' A' ' 28' ' ' VAL . . . -132.73 155.93 47.96 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.236 170.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 27' ' ' LEU . 29.5 mtpp -131.93 140.18 48.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.644 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.95 132.51 5.76 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.354 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 60.9 t -116.53 133.33 63.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.896 0.379 . . . . 0.0 110.525 -177.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.06 139.33 49.96 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.611 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.3 m -97.69 119.0 35.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.005 0.431 . . . . 0.0 110.544 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.534 HG23 ' HB3' ' A' ' 22' ' ' ALA . 11.7 m -130.49 166.53 27.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.859 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.73 150.83 36.23 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.408 HG12 ' ND2' ' A' ' 78' ' ' ASN . 24.2 t -61.0 -32.98 53.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.73 0.776 . . . . 0.0 109.151 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -56.85 -38.81 73.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.94 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.08 -41.08 91.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 -175.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -34.31 62.71 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.673 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.408 ' ND2' HG12 ' A' ' 74' ' ' VAL . 69.8 m-20 -69.91 -20.38 63.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.656 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -102.3 8.16 40.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.023 0.439 . . . . 0.0 110.772 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 59.74 38.12 21.82 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.753 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -63.58 164.09 10.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.094 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 42.1 mp0 -107.64 137.17 46.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.602 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 100' ' ' ILE . 60.0 m-85 -129.58 148.24 51.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.875 174.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.609 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 2.6 p -133.19 135.12 57.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.4 p -104.74 142.92 33.85 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.111 0.481 . . . . 0.0 110.808 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -113.96 130.22 56.54 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.732 176.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.528 HG21 ' HB ' ' A' ' 6' ' ' THR . 59.0 t -104.64 127.15 59.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.783 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 m -127.47 94.5 4.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.424 0.63 . . . . 0.0 110.726 -173.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.457 ' C ' ' H ' ' A' ' 91' ' ' ASP . 1.4 t60 -99.54 -10.84 21.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.045 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.89 -6.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.692 0.758 . . . . 0.0 109.552 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 89' ' ' HIS . 19.8 t70 -72.82 -29.43 63.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.32 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -118.57 154.47 52.46 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.319 178.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.64 -20.33 17.89 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.118 2.545 . . . . 0.0 112.937 -177.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 52.1 p -132.13 118.57 16.32 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 18.6 Cg_endo -58.22 141.11 96.46 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.749 2.299 . . . . 0.0 111.362 177.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.521 ' O ' ' HA ' ' A' ' 86' ' ' THR . 45.4 mt-30 -83.9 149.71 26.18 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.636 -177.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 28.3 mtpp -125.74 137.31 53.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 -176.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 71.3 mmtt -129.9 133.96 47.19 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.58 ' HD1' HE22 ' A' ' 44' ' ' GLN . 42.3 m-85 -101.23 124.41 46.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.33 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.529 HG22 ' O ' ' A' ' 83' ' ' PHE . 13.0 tt -122.0 141.3 42.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.896 0.379 . . . . 0.0 111.15 -178.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.505 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 22.8 p -156.86 149.53 23.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.469 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.921 -0.561 . . . . 0.0 109.489 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 CA--C 1.517 -0.311 0 CA-C-O 120.67 0.272 . . . . 0.0 110.643 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.499 HG23 HD23 ' A' ' 31' ' ' LEU . 28.2 mt -62.18 121.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.591 -176.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.459 HD12 HD22 ' A' ' 30' ' ' ASN . 86.5 mt -115.49 132.83 56.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.831 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.1 t -121.31 130.54 53.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -125.0 146.65 49.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.519 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.1 p -116.41 137.79 51.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.061 0.458 . . . . 0.0 111.12 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.516 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -117.89 126.6 27.18 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.974 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HA ' HD11 ' A' ' 100' ' ' ILE . 96.0 Cg_endo -78.7 148.36 22.69 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 123.048 2.499 . . . . 0.0 112.55 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -77.51 150.16 27.91 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.601 2.201 . . . . 0.0 111.506 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.7 t -88.97 149.14 23.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.512 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.3 -43.31 71.01 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -60.97 -46.26 91.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.421 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.92 -37.15 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.176 -177.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 12' ' ' SER . 71.0 mt -61.46 -36.92 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.079 0.466 . . . . 0.0 110.434 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -72.22 -43.82 63.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.187 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 14' ' ' ALA . 10.8 mp -66.92 -48.45 68.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.235 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -75.51 -12.81 60.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.476 -178.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 70.79 -10.65 0.71 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.298 0.639 . . . . 0.0 111.131 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 19' ' ' SER . 10.0 p -138.72 147.38 42.65 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.233 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.599 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.08 156.78 19.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 31.1 m-80 -139.42 116.84 11.3 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.639 -171.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.593 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.43 144.1 44.43 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 174.587 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.516 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 39.1 m -125.27 124.21 41.16 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.086 0.47 . . . . 0.0 110.415 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 26.2 t -112.1 136.93 50.86 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.818 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -125.08 122.68 37.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 65' ' ' SER . 24.3 t -121.98 126.42 74.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.7 m -139.14 176.39 8.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.383 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.459 HD22 HD12 ' A' ' 5' ' ' LEU . 97.8 m-20 57.32 50.61 11.23 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.86 0.725 . . . . 0.0 111.242 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.499 HD23 HG23 ' A' ' 4' ' ' ILE . 65.2 mt -74.66 149.55 39.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.742 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.9 -177.53 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.5 m120 . . . . . 0 C--O 1.234 0.252 0 N-CA-C 110.302 -0.258 . . . . 0.0 110.302 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.657 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.7 mm -122.14 137.63 55.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 t -136.26 143.77 44.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.685 0.279 . . . . 0.0 110.369 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.411 ' CH2' ' HB3' ' A' ' 24' ' ' LEU . 66.7 m95 -129.15 145.82 51.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.981 0.419 . . . . 0.0 110.785 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.78 139.82 17.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.591 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.542 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 29.5 t -66.36 155.26 37.86 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.117 0.484 . . . . 0.0 110.387 174.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -62.89 -24.1 67.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.185 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.409 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m -76.67 -3.77 39.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.051 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.83 21.7 38.78 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.755 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 21.5 mt-10 -92.67 121.1 66.8 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 17.1 Cg_exo -66.12 134.23 35.96 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.932 1.755 . . . . 0.0 111.419 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.896 HD12 ' HB1' ' A' ' 70' ' ' ALA . 1.7 mm? -102.68 141.48 35.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.302 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -92.01 107.4 19.18 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.656 176.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.0 m . . . . . 0 C--N 1.319 -0.732 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.832 -174.563 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 1.4 m . . . . . 0 N--CA 1.445 -0.689 0 CA-C-O 121.515 0.674 . . . . 0.0 112.305 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.54 149.81 29.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.064 164.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 39.5 mtpt -131.94 141.24 49.26 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.657 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.63 131.66 5.59 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.6 -177.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -122.93 124.13 69.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.989 0.423 . . . . 0.0 110.632 -177.139 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.896 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -116.36 147.38 41.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.351 -176.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -104.85 123.64 48.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.988 0.423 . . . . 0.0 111.309 -172.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.607 HG12 HD11 ' A' ' 49' ' ' LEU . 6.4 m -125.38 164.4 24.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.281 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.4 t -82.21 153.72 25.8 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.47 -33.75 52.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.154 0.502 . . . . 0.0 110.256 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 7.8 mm-40 -59.93 -33.34 71.76 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.863 -179.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 15.6 m-20 -64.55 -42.43 95.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.436 0.636 . . . . 0.0 109.387 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.0 OUTLIER -74.03 -35.44 64.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.546 179.071 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 69.3 m-20 -64.23 -33.42 75.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.341 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -90.72 8.23 35.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.112 0.482 . . . . 0.0 110.663 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 54.5 38.28 29.42 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.345 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 57.3 mtpt -66.36 159.81 26.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.751 175.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -118.08 141.22 48.71 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.972 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.475 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 96.6 m-85 -120.04 151.57 38.81 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.224 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.9 t -121.42 129.41 75.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.583 -173.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.618 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 45.1 t -105.77 122.39 46.0 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.496 -0.482 . . . . 0.0 109.714 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.8 112.2 25.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.185 0.517 . . . . 0.0 110.701 176.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.43 ' HB ' ' CG ' ' A' ' 96' ' ' GLN . 43.2 t -97.53 125.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.126 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.5 m -118.46 112.81 20.44 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.619 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 7.3 t-160 -97.98 -50.4 4.42 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.058 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 42.4 ttm180 144.89 -33.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 O-C-N 125.396 1.685 . . . . 0.0 109.947 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.479 ' OD1' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -72.04 -35.19 69.27 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.959 -168.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.64 146.05 32.39 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 121.426 0.631 . . . . 0.0 111.301 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.14 -19.24 26.42 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 123.54 2.827 . . . . 0.0 112.466 -174.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 24.0 t -144.13 135.54 12.69 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.74 141.4 95.61 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.047 2.498 . . . . 0.0 112.396 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.43 ' CG ' ' HB ' ' A' ' 87' ' ' VAL . 3.5 pt20 -81.42 133.25 35.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.818 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.3 ptpt -114.82 142.71 46.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.304 0.574 . . . . 0.0 111.707 -175.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 32.7 mmtm -129.73 140.0 51.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.232 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CD1' HG22 ' A' ' 84' ' ' VAL . 79.3 m-85 -101.36 133.45 45.94 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.035 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.4 tt -128.68 136.3 60.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.996 0.426 . . . . 0.0 111.182 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.3 p -158.74 146.72 18.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.074 176.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.633 -176.484 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 . . . . . 0 CA--C 1.518 -0.277 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.6 HG23 HD22 ' A' ' 31' ' ' LEU . 68.1 mt -60.37 129.08 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 169.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.3 mt -104.1 128.82 51.76 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.156 -171.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.412 HG23 ' HD3' ' A' ' 98' ' ' LYS . 4.1 t -120.3 129.31 53.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.717 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -131.13 141.98 50.19 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.738 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 p -113.08 133.63 54.91 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.848 176.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.3 mp -116.58 124.8 29.01 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.051 -175.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.507 ' HA ' HD11 ' A' ' 100' ' ' ILE . 52.5 Cg_endo -69.57 139.1 40.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.694 2.262 . . . . 0.0 111.687 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 55.7 Cg_endo -65.82 144.17 76.35 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.886 2.39 . . . . 0.0 111.837 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.1 m -85.64 148.59 25.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.641 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -54.71 -42.38 71.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.727 0.24 . . . . 0.0 111.275 -173.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -57.81 -45.1 86.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.325 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.83 -42.19 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.85 0.357 . . . . 0.0 110.817 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 21' ' ' SER . 62.1 mt -66.15 -38.82 82.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.661 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -74.03 -43.25 58.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.12 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -64.25 -47.7 78.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.727 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 78.6 p -85.98 -12.31 50.71 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.233 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 32.7 mmtp 65.47 17.43 10.95 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.742 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 23.1 m -139.13 147.21 41.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.394 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -92.04 136.72 32.95 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -114.17 122.95 48.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.635 -173.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 83.4 mt -85.3 125.4 32.89 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.668 177.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.9 m -113.64 123.98 51.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.314 0.578 . . . . 0.0 111.434 -176.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.546 ' HB3' HD12 ' A' ' 39' ' ' ILE . 18.2 t -124.38 137.05 54.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.656 176.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.51 124.22 26.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 12.1 t -119.2 129.92 74.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.5 p -143.19 177.37 8.45 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.228 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 15.2 m120 62.53 50.33 3.64 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.706 0.765 . . . . 0.0 109.772 174.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.6 HD22 HG23 ' A' ' 4' ' ' ILE . 0.9 OUTLIER -74.56 65.9 1.34 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.869 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.3 -1.553 0 CA-C-N 113.641 -1.618 . . . . 0.0 109.883 177.526 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.67 ' N ' ' HB ' ' A' ' 87' ' ' VAL . 63.7 t30 . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.575 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.7 mm -122.9 130.47 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 C-N-CA 118.77 -1.172 . . . . 0.0 109.794 169.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.8 t -155.53 121.88 5.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 78.0 m95 -103.04 142.27 34.39 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.447 0.641 . . . . 0.0 111.663 -174.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.05 164.97 36.11 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.116 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.48 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 86.9 p -82.17 168.39 17.74 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 177.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -63.7 -22.82 67.1 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.292 0.567 . . . . 0.0 110.259 174.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -87.43 -5.49 58.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.222 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.36 22.37 29.59 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.793 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 6.5 pt-20 -93.09 133.14 29.21 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 117.449 0.624 . . . . 0.0 109.433 176.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 16.3 Cg_exo -67.8 136.52 38.98 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.689 2.259 . . . . 0.0 112.306 -177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.2 mt -109.02 140.83 42.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.785 178.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.35 107.22 0.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.475 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 7.8 m . . . . . 0 C--N 1.313 -0.988 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.745 -179.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 m . . . . . 0 C--O 1.233 0.185 0 CA-C-O 121.163 0.506 . . . . 0.0 112.193 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.26 135.35 50.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.076 168.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -131.14 138.88 49.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.575 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -144.89 141.22 9.77 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 48.0 t -123.67 133.74 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.629 0.252 . . . . 0.0 110.739 -174.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.495 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -116.15 142.61 46.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 p -100.0 115.46 29.75 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.956 0.408 . . . . 0.0 111.175 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.554 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.9 m -119.44 166.47 13.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.867 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.1 t -81.02 151.89 28.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.24 -24.99 36.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.86 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.71 -34.76 77.52 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.987 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.41 -49.75 76.58 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.453 0.644 . . . . 0.0 109.778 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.579 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -67.78 -34.26 76.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.753 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -68.97 -30.37 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.26 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -92.93 8.58 39.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.325 . . . . 0.0 110.602 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 59.89 36.76 21.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.475 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -63.41 154.67 31.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.298 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 100' ' ' ILE . 25.6 tt0 -118.27 139.31 51.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.558 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 87.5 m-85 -122.64 162.85 21.13 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.49 -176.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.582 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.7 t -131.35 126.35 58.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.984 -175.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 45.9 t -111.44 123.51 50.36 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -110.68 125.62 53.65 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.67 ' HB ' ' N ' ' A' ' 38' ' ' ASN . 1.6 m -107.23 145.63 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.152 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.233 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.469 ' H ' ' HB3' ' A' ' 38' ' ' ASN . 2.6 p -143.45 81.2 1.7 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.521 0.676 . . . . 0.0 112.537 -164.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.488 ' HD2' ' HB2' ' A' ' 91' ' ' ASP . 35.4 t60 -82.63 -9.15 59.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.54 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.14 21.07 12.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -170.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.488 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 9.2 t70 -84.46 -33.48 23.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.369 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.414 HD12 ' H ' ' A' ' 92' ' ' LEU . 0.3 OUTLIER -136.53 163.11 52.19 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.167 -179.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.23 -31.13 14.89 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.51 2.14 . . . . 0.0 112.651 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.467 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 3.9 p -109.5 102.49 49.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.474 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.467 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 37.9 Cg_endo -64.11 152.38 81.31 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 123.198 2.599 . . . . 0.0 111.666 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.421 ' O ' ' HA ' ' A' ' 86' ' ' THR . 35.6 mt-30 -95.82 130.51 42.73 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.052 -175.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -105.78 132.85 51.41 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.893 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.582 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 3.5 mmmp? -114.52 137.51 51.76 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.544 -178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -101.28 138.85 37.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.811 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.507 HD11 ' HA ' ' A' ' 10' ' ' PRO . 11.4 tt -144.24 137.64 23.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 p -157.51 149.56 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.838 0.351 . . . . 0.0 111.347 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 21.5 tptm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.028 177.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 . . . . . 0 CA--C 1.519 -0.243 0 CA-C-O 120.945 0.402 . . . . 0.0 110.836 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.416 HG23 ' CD1' ' A' ' 31' ' ' LEU . 69.4 mt -66.97 122.26 17.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.681 -174.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -105.62 135.3 47.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.395 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.509 HG23 ' HE2' ' A' ' 98' ' ' LYS . 4.3 t -125.9 130.16 50.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.271 0.558 . . . . 0.0 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -126.6 136.41 52.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.808 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 p -113.75 132.18 55.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.035 0.445 . . . . 0.0 111.391 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -119.21 126.0 27.29 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.203 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.84 145.79 36.85 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.844 2.362 . . . . 0.0 111.815 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -64.21 151.54 84.96 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.5 2.134 . . . . 0.0 111.928 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 p -97.33 151.6 19.75 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.817 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -54.04 -43.45 70.19 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.692 0.282 . . . . 0.0 111.489 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.456 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.09 -46.35 84.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.125 -178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -64.66 -41.24 96.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.059 -176.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.75 -36.61 76.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.709 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.45 -45.39 54.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.051 0.453 . . . . 0.0 111.099 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.5 mm? -67.24 -48.28 68.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -74.01 -20.25 60.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.13 0.49 . . . . 0.0 110.888 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 64.44 11.03 6.21 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.917 0.865 . . . . 0.0 110.301 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 m -138.78 141.56 38.79 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.268 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.545 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -86.92 155.4 20.23 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.3 p30 -158.17 129.15 6.42 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.867 0.365 . . . . 0.0 110.738 -173.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -87.1 142.99 27.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.9 m -122.31 116.98 25.02 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.639 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.5 t -111.42 131.56 55.1 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.742 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.2 tt -121.44 128.89 52.6 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.17 0.509 . . . . 0.0 109.879 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.501 HG12 HD11 ' A' ' 31' ' ' LEU . 33.3 t -121.51 132.33 70.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.656 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -142.5 175.95 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.895 0.379 . . . . 0.0 111.235 -172.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 30' ' ' ASN . 0.9 OUTLIER 63.48 46.98 4.03 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.414 175.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.595 HD22 ' H ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -85.94 150.73 24.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.088 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.326 -0.455 0 CA-C-O 121.319 0.58 . . . . 0.0 109.465 176.374 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 . . . . . 0 C--O 1.234 0.238 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.718 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.2 mm -121.56 137.44 55.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.6 t -146.45 144.6 29.79 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.693 0.283 . . . . 0.0 110.741 -179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 64.5 m95 -125.19 156.75 37.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.139 0.495 . . . . 0.0 111.443 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.39 155.1 29.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.505 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.3 m -80.04 157.54 26.72 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -53.51 -25.14 15.38 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.082 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.0 p -78.66 -2.15 37.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.55 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.47 22.06 48.89 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.776 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 42.6 mt-10 -99.55 123.82 46.69 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 25.1 Cg_exo -61.07 136.24 63.98 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.482 2.121 . . . . 0.0 112.097 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.1 mt -101.8 146.29 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.137 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -68.17 105.74 2.19 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 175.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 6.3 m . . . . . 0 C--N 1.319 -0.724 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.524 -177.831 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.4 m . . . . . 0 C--O 1.236 0.342 0 CA-C-O 121.118 0.485 . . . . 0.0 111.936 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -110.3 148.78 31.26 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 18.5 ptpt -132.64 141.22 48.54 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.339 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.718 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.27 128.95 6.12 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.781 178.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.9 t -109.83 127.04 66.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.908 0.385 . . . . 0.0 110.285 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.605 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.13 130.28 56.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.33 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.0 p -97.37 114.55 26.38 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.288 0.566 . . . . 0.0 111.007 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.545 HG23 ' HB3' ' A' ' 22' ' ' ALA . 17.9 m -119.8 167.15 13.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.083 -176.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.4 m -74.69 146.64 42.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.6 t -58.98 -33.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.45 0.643 . . . . 0.0 109.63 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.64 -33.57 71.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.722 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -63.5 -44.23 94.92 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.362 0.601 . . . . 0.0 109.653 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.466 ' NE1' ' HD3' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -74.29 -34.13 63.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.522 179.501 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -66.99 -25.16 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -95.35 7.38 46.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.703 177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 54.49 37.79 28.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.5 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -63.97 158.46 22.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.137 0.494 . . . . 0.0 111.144 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 35.0 tt0 -109.32 139.53 44.15 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.632 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -123.07 156.83 34.11 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.095 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.425 HG22 ' CD1' ' A' ' 99' ' ' PHE . 98.7 t -125.54 126.04 69.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.489 -175.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.838 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.3 p -105.48 142.84 34.54 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -123.26 124.22 42.5 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.194 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.8 t -93.73 125.55 46.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 p -119.66 87.11 2.68 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.564 0.697 . . . . 0.0 111.061 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' HB3' ' A' ' 31' ' ' LEU . 10.1 t60 -98.42 -11.55 22.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.311 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.549 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 0.6 OUTLIER 71.14 -20.75 0.21 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.508 0.723 . . . . 0.0 111.28 -178.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.463 ' H ' ' C ' ' A' ' 89' ' ' HIS . 25.0 t70 -72.35 -36.29 68.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.987 0.422 . . . . 0.0 110.431 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.36 150.71 61.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.428 177.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 -20.15 15.23 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.93 2.42 . . . . 0.0 112.508 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 57.3 p -145.46 130.52 9.14 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.447 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 15.4 Cg_endo -57.35 140.73 93.93 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.512 2.141 . . . . 0.0 111.561 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' THR . 46.9 mt-30 -86.9 132.91 33.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -107.93 135.83 48.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.575 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.838 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 65.9 mmtt -126.54 135.74 51.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.885 174.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.425 ' CD1' HG22 ' A' ' 84' ' ' VAL . 61.5 m-85 -101.46 129.97 47.61 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.734 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 13.9 tt -128.51 138.99 53.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.668 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.5 t -154.85 149.98 26.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.466 ' HD3' ' NE1' ' A' ' 77' ' ' TRP . 22.8 tptm . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.931 -177.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.464 0.233 0 CA-C-O 121.605 0.717 . . . . 0.0 111.304 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.481 HG23 HD23 ' A' ' 31' ' ' LEU . 77.8 mt -68.93 122.76 20.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.974 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.0 mt -104.44 130.14 52.36 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.497 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 2.4 t -127.93 130.31 48.26 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.197 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -128.44 146.34 50.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.005 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.4 p -112.64 135.01 53.87 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.27 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.96 122.25 31.6 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.004 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.48 141.35 50.58 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.999 2.466 . . . . 0.0 111.967 177.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.543 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.4 Cg_endo -67.87 150.19 78.35 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.605 2.203 . . . . 0.0 111.424 177.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.0 t -78.88 131.23 36.35 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.71 -177.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.602 ' HB2' ' HE3' ' A' ' 102' ' ' LYS . 61.6 t80 -58.83 -34.01 71.06 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.114 -174.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.65 76.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.337 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.86 -38.08 87.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.055 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 ' HG2' ' A' ' 11' ' ' PRO . 75.1 mt -62.08 -36.82 76.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.355 176.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -72.38 -44.31 62.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.568 -178.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.4 mp -71.02 -48.28 53.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.586 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.3 m -79.67 -16.18 56.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.871 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 60.7 19.85 9.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.903 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.6 m -139.87 129.94 25.0 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.49 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -90.43 154.83 19.37 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -160.13 130.31 5.42 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.859 0.361 . . . . 0.0 110.733 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -84.22 138.29 33.04 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.4 m -120.62 127.04 51.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 -178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.517 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 46.5 t -114.53 138.0 51.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.011 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -122.59 123.11 40.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 65' ' ' SER . 46.6 t -120.96 127.05 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.078 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.5 t -143.69 178.8 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.75 0.309 . . . . 0.0 111.235 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 60.02 33.58 21.36 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.314 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.481 HD23 HG23 ' A' ' 4' ' ' ILE . 56.3 mt -57.11 142.28 43.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.728 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.237 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.432 178.794 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.9 m120 . . . . . 0 CA--C 1.518 -0.264 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.687 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.1 mm -121.25 136.69 57.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.5 t -138.99 153.19 48.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.517 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 73.9 m95 -134.51 146.99 50.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.383 0.611 . . . . 0.0 111.798 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.47 165.72 34.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.702 -1.136 . . . . 0.0 107.969 176.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.538 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 63.1 p -88.13 173.32 8.9 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.955 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 82' ' ' GLU . 6.0 tp-100 -58.77 -34.97 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.401 0.62 . . . . 0.0 110.062 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.9 m -78.55 -5.7 53.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.806 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 11.71 59.38 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.225 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.538 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 7.1 pt-20 -76.38 131.75 74.22 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -64.43 138.28 59.4 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.282 1.988 . . . . 0.0 112.012 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 49' ' ' LEU . 8.9 mt -120.16 136.07 54.75 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.463 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.92 107.58 7.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.233 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.9 m . . . . . 0 C--N 1.321 -0.663 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.525 -177.82 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.616 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 11.1 m . . . . . 0 N--CA 1.442 -0.867 0 CA-C-O 121.288 0.566 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.443 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -141.49 162.43 35.51 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.065 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -130.27 140.75 50.66 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.687 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.39 127.62 3.87 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.603 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -124.97 133.27 69.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.09 0.472 . . . . 0.0 111.065 -173.512 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.73 134.51 55.04 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.663 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -96.77 119.11 34.64 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.126 0.489 . . . . 0.0 110.327 -174.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' A' ' 22' ' ' ALA . 20.0 m -126.35 166.28 22.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.269 -175.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.9 t -75.02 154.65 37.93 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.2 t -61.2 -33.47 56.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 13.2 mm-40 -62.57 -30.8 71.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.748 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.68 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 6.4 m-20 -59.7 -50.99 71.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.171 0.51 . . . . 0.0 109.652 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -63.11 -37.15 86.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.007 176.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 90.6 m-20 -69.49 -18.89 63.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.857 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -94.27 7.06 46.71 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.12 -0.363 . . . . 0.0 111.02 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 57.78 27.36 14.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.874 0.845 . . . . 0.0 109.525 -174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 76' ' ' ASP . 1.3 tppp? -68.5 142.64 55.23 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.188 -1.369 . . . . 0.0 109.963 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 58.1 mt-10 -105.99 143.93 33.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.929 0.395 . . . . 0.0 110.074 -178.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.496 ' HA ' ' HA ' ' A' ' 43' ' ' SER . 71.3 m-85 -121.62 154.86 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.839 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 67.1 t -127.68 133.76 66.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.18 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 39.9 t -105.28 132.65 51.21 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.2 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.49 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -114.87 119.7 37.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.331 176.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.99 126.91 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.967 -178.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.27 98.48 5.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.645 0.736 . . . . 0.0 110.907 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -99.36 -10.51 22.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.161 -177.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.44 ' O ' ' HD2' ' A' ' 90' ' ' ARG . 1.6 tmm_? 69.91 7.12 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 122.122 0.963 . . . . 0.0 108.85 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.479 ' HB3' HD11 ' A' ' 4' ' ' ILE . 13.0 t70 -84.23 -33.73 24.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.287 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.73 152.56 65.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.073 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.85 -23.86 16.02 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.061 2.508 . . . . 0.0 112.961 -175.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.5 t -131.17 124.45 20.43 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 110.109 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.8 Cg_endo -60.53 142.51 98.15 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 123.498 2.798 . . . . 0.0 112.848 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -81.99 141.41 33.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.908 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.49 ' HG2' HG23 ' A' ' 86' ' ' THR . 30.6 mtpp -112.11 127.03 55.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 0.0 110.549 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.659 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 71.9 mmtt -117.64 140.05 50.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.51 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.428 ' CD1' HG22 ' A' ' 84' ' ' VAL . 72.8 m-85 -101.59 131.73 47.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.3 tt -121.94 138.14 53.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.249 0.547 . . . . 0.0 111.336 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.1 t -159.06 150.69 20.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.096 176.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.602 ' HE3' ' HB2' ' A' ' 13' ' ' PHE . 42.7 tttm . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.684 176.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 N--CA 1.469 0.483 0 CA-C-O 120.901 0.382 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.738 HD12 ' HB3' ' A' ' 92' ' ' LEU . 44.9 mt -59.69 121.21 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.993 0.425 . . . . 0.0 111.155 -172.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.2 mt -117.53 132.18 56.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.322 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.32 127.3 53.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.815 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -115.96 130.39 56.8 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.554 ' HB ' HD12 ' A' ' 100' ' ' ILE . 11.2 p -115.9 136.46 53.02 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.014 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -116.54 119.21 36.28 Favored Pre-proline 0 N--CA 1.442 -0.844 0 CA-C-O 121.069 0.461 . . . . 0.0 110.042 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 61.1 Cg_endo -71.59 138.98 33.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.554 2.169 . . . . 0.0 111.065 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.429 ' HD2' ' CE2' ' A' ' 77' ' ' TRP . 54.6 Cg_endo -66.97 151.8 81.46 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.593 2.195 . . . . 0.0 111.711 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 16' ' ' ILE . 20.7 t -82.01 137.42 35.1 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.523 ' HA ' HD12 ' A' ' 16' ' ' ILE . 24.4 t80 -57.88 -30.48 65.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.911 -174.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -69.09 -46.07 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.565 176.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.55 -39.81 94.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.497 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 13' ' ' PHE . 72.1 mt -59.48 -37.51 70.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.577 176.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -68.72 -42.39 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.361 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.2 mt -61.92 -40.15 94.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.811 -177.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.443 ' C ' ' H ' ' A' ' 21' ' ' SER . 25.9 t -88.3 -13.71 40.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.051 -179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' SER . 86.0 tttt 70.88 -8.47 0.95 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.711 0.767 . . . . 0.0 110.618 -174.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 19' ' ' SER . 20.0 m -132.41 144.57 50.6 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.268 -178.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.836 ' HB3' ' HB ' ' A' ' 72' ' ' VAL . . . -78.54 175.42 10.37 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.556 ' HA ' HG23 ' A' ' 72' ' ' VAL . 9.9 p30 -160.12 138.05 9.93 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -177.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 31.9 mt -105.97 125.65 51.24 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.01 -176.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.3 m -109.0 127.32 53.98 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.999 0.428 . . . . 0.0 110.54 -177.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.62 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.4 t -118.26 137.13 53.25 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.976 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.15 122.68 32.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.521 ' O ' ' HA ' ' A' ' 65' ' ' SER . 39.2 t -116.08 128.37 73.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.0 p -142.26 177.31 8.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.78 0.324 . . . . 0.0 111.365 -174.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 59.79 38.36 21.53 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.723 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.473 HD23 HG23 ' A' ' 4' ' ' ILE . 69.8 mt -66.49 131.65 46.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.759 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . . . . . . 0 CA--C 1.522 -0.108 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.579 -178.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 . . . . . 0 C--O 1.234 0.247 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.614 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -121.05 136.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.1 t -135.48 135.78 40.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.721 0.296 . . . . 0.0 110.271 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.62 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 68.8 m95 -123.24 139.0 54.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.093 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.77 160.14 42.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.741 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.406 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 79.0 p -87.65 161.53 17.63 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.18 176.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.68 -21.42 66.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.059 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.4 p -76.46 -8.46 57.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.811 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.67 22.44 31.16 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.767 -0.73 . . . . 0.0 113.036 176.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -94.47 121.96 62.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.26 135.3 53.42 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.055 1.836 . . . . 0.0 110.516 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.2 mt -108.31 139.79 42.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.367 0.604 . . . . 0.0 111.885 -171.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 3.6 tm-20 -57.22 116.51 3.32 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.386 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 m . . . . . 0 C--N 1.319 -0.74 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 -175.897 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 19.3 m . . . . . 0 N--CA 1.445 -0.723 0 CA-C-O 121.203 0.525 . . . . 0.0 109.86 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -143.03 163.92 31.49 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.73 -172.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -127.89 137.99 52.51 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 176.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.614 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -147.02 131.57 4.01 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.702 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.5 p -129.42 137.93 55.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.68 0.276 . . . . 0.0 110.899 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.5 151.48 33.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.5 -177.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 26.3 m -98.0 114.16 26.21 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 122.38 1.086 . . . . 0.0 110.89 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.836 ' HB ' ' HB3' ' A' ' 22' ' ' ALA . 1.7 t -116.93 167.83 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.526 -172.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.414 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 19.0 m -100.13 139.97 35.03 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 175.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 1.9 p -54.32 -36.61 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-O 121.174 0.512 . . . . 0.0 110.475 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -56.41 -36.55 69.06 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.888 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.565 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 44.3 m-20 -67.26 -48.84 66.52 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.297 0.57 . . . . 0.0 109.938 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.429 ' CE2' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -69.12 -34.56 75.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.264 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 11.5 t-20 -66.14 -22.03 66.36 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.241 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -102.12 10.66 39.29 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.128 177.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 80' ' ' ARG . 13.4 mmt180 58.78 36.71 24.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.306 178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.565 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 61.9 mtpt -74.26 164.25 26.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.991 0.424 . . . . 0.0 110.753 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.82 148.98 42.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.812 -176.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 93.7 m-85 -130.64 162.06 30.22 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.222 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.4 t -119.58 129.51 75.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.333 0.587 . . . . 0.0 110.953 -177.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 37.7 t -105.45 140.31 38.74 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 173.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 m -126.2 132.79 51.7 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.7 t -112.6 125.69 69.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.092 0.472 . . . . 0.0 111.08 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -107.6 85.76 2.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.616 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.509 ' HB3' HD22 ' A' ' 92' ' ' LEU . 3.5 t60 -98.8 -16.84 18.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.898 -176.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 70.89 -22.09 0.19 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.102 0.561 . . . . 0.0 111.408 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.496 ' H ' ' C ' ' A' ' 89' ' ' HIS . 14.5 t0 -72.26 -37.04 69.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.661 0.743 . . . . 0.0 110.767 -178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 4' ' ' ILE . 1.4 pt? -89.55 147.66 38.42 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.057 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -50.41 -32.91 35.75 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.506 2.137 . . . . 0.0 112.717 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 31.5 m -155.93 154.8 28.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -51.74 139.44 48.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.463 2.108 . . . . 0.0 112.062 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.8 pt20 -94.85 141.89 28.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.453 -177.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -107.73 127.59 53.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.138 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -120.23 132.89 55.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.624 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.36 135.72 41.36 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -177.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' A' ' 8' ' ' THR . 11.9 tt -126.6 137.45 57.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.8 p -158.61 149.55 20.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.248 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.008 179.463 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 . . . . . 0 N--CA 1.451 -0.384 0 CA-C-O 120.782 0.325 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.466 HG23 HD23 ' A' ' 31' ' ' LEU . 64.9 mt -60.2 123.68 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.688 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 65.7 mt -111.78 131.49 55.29 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.053 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.2 t -117.42 130.58 56.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.588 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.9 135.4 51.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.335 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -113.36 132.78 55.47 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.836 0.35 . . . . 0.0 110.754 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -117.62 124.25 29.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.653 -174.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.41 139.45 49.52 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.692 2.262 . . . . 0.0 111.583 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.402 ' HG2' HD11 ' A' ' 16' ' ' ILE . 48.9 Cg_endo -67.18 156.09 67.81 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.993 2.462 . . . . 0.0 112.741 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 16' ' ' ILE . 43.9 t -84.17 137.56 33.45 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.493 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -61.37 -42.42 98.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.469 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.96 -35.58 81.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.984 0.421 . . . . 0.0 110.444 177.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -68.02 -44.25 76.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.326 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 12' ' ' SER . 81.1 mt -59.75 -36.8 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.627 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -72.3 -44.09 63.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.517 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.92 -48.07 75.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.504 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 t -75.15 -21.41 58.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttm 69.4 7.05 6.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.695 0.759 . . . . 0.0 110.309 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.5 t -138.49 142.1 39.39 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.501 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.8 144.38 26.27 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.561 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -130.39 120.36 24.15 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.495 0.664 . . . . 0.0 110.821 -174.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.8 mt -78.1 129.72 35.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.233 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.2 m -116.24 126.17 53.24 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.283 0.563 . . . . 0.0 111.107 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.0 t -127.17 137.0 52.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.149 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.13 137.05 48.86 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.642 177.045 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.626 HG22 ' HB3' ' A' ' 66' ' ' ALA . 11.8 m -117.65 145.3 23.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -142.36 176.43 9.0 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 58.32 48.77 11.99 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.544 0.527 . . . . 0.0 112.068 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.466 HD23 HG23 ' A' ' 4' ' ' ILE . 26.2 mt -82.11 117.03 21.96 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.439 0 CA-C-O 121.399 0.619 . . . . 0.0 110.685 178.145 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.513 -0.473 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.572 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.8 mm -120.5 136.32 57.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 176.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.4 m -128.36 126.59 41.0 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.29 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.42 ' HB2' ' OG1' ' A' ' 51' ' ' THR . 67.8 m95 -108.29 137.84 45.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.794 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.03 165.15 34.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.175 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.717 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 24.1 t -79.61 173.27 12.76 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 173.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HG23 ' A' ' 84' ' ' VAL . 52.7 tt0 -53.3 -33.67 54.22 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.4 t -77.52 -7.74 56.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.801 0.334 . . . . 0.0 111.473 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.16 30.44 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.554 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.717 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 9.9 pt-20 -89.2 124.85 63.79 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.34 142.59 94.96 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.712 2.941 . . . . 0.0 114.489 -168.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.3 mt -120.47 147.39 45.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.524 175.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 23.1 mm-40 -63.26 106.63 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.319 0.58 . . . . 0.0 111.059 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 18.5 m . . . . . 0 C--N 1.32 -0.708 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.915 -177.31 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.46 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 19.3 m . . . . . 0 N--CA 1.451 -0.409 0 CA-C-O 120.835 0.35 . . . . 0.0 111.927 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -108.38 155.25 20.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 172.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -130.6 141.37 50.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.108 0.48 . . . . 0.0 110.391 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.572 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.56 123.09 2.79 Favored Glycine 0 N--CA 1.437 -1.288 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.687 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.7 p -125.48 131.37 72.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 120.959 0.409 . . . . 0.0 111.187 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.561 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.33 142.47 46.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.294 -177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 m -98.63 114.03 26.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.501 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.1 m -123.01 165.97 18.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.6 t -78.02 151.81 33.35 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.2 -29.26 46.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 4.3 mm-40 -66.29 -32.71 74.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.413 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -60.39 -45.4 93.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.352 0.596 . . . . 0.0 109.512 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.564 ' CD1' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -72.04 -35.0 69.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.431 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 72.1 m-20 -67.03 -32.77 74.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.373 178.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -95.34 11.67 31.84 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? 63.38 38.67 9.94 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.293 0.371 . . . . 0.0 111.986 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -66.03 154.7 38.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -119.92 139.79 51.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.211 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.407 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 78.9 m-85 -128.29 160.64 31.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.609 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.597 HG23 ' HA ' ' A' ' 44' ' ' GLN . 69.5 t -125.23 125.17 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.337 -178.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 33.9 t -105.76 132.28 52.07 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.588 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -121.14 134.0 55.22 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -179.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.42 125.9 72.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.846 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -123.12 105.64 10.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.193 0.521 . . . . 0.0 110.451 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.1 t60 -101.02 -10.53 20.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.086 -177.353 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.636 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 1.0 OUTLIER 74.1 -0.7 3.28 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 0.0 109.417 -170.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 4' ' ' ILE . 24.0 t0 -72.56 -36.62 68.27 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.156 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.19 154.23 58.47 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.372 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -75.16 -21.86 15.14 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.956 2.437 . . . . 0.0 112.779 -177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.1 m -130.1 119.58 18.84 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.106 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.588 ' HB2' HG22 ' A' ' 86' ' ' THR . 50.6 Cg_endo -69.1 143.24 53.32 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.866 2.377 . . . . 0.0 112.725 -177.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -81.2 142.0 33.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.562 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 19.7 ptpt -116.53 143.08 46.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.023 0.439 . . . . 0.0 111.059 179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 48.1 mmtt -122.01 140.83 52.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.608 178.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -101.14 146.33 27.61 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 tt -144.9 137.72 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.007 -0.677 . . . . 0.0 112.43 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 p -159.21 142.9 14.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.564 ' HD3' ' CD1' ' A' ' 77' ' ' TRP . 20.8 pttp . . . . . 0 C--O 1.247 0.953 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.444 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 . . . . . 0 CA--C 1.516 -0.356 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.54 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.3 mt -60.2 121.78 8.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.636 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 30' ' ' ASN . 83.9 mt -104.15 131.02 51.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.115 0.484 . . . . 0.0 111.413 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -121.59 119.45 31.94 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.648 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -116.29 132.27 56.71 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 98' ' ' LYS . 6.6 p -112.45 131.02 55.78 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.234 0.54 . . . . 0.0 110.701 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.9 mm -117.74 123.96 29.26 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.785 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 43.5 Cg_endo -67.33 139.22 49.1 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.203 1.935 . . . . 0.0 110.391 173.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.53 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 56.5 Cg_endo -63.77 132.38 34.78 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.053 1.836 . . . . 0.0 110.658 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.5 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 15.4 t -78.5 145.39 34.97 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.852 -176.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -59.57 -29.39 67.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.323 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.415 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -65.53 -46.45 79.54 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 174.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 12' ' ' SER . 31.0 m-20 -64.96 -43.6 92.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.607 -179.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.5 mt -58.32 -34.65 50.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.581 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -72.14 -42.39 66.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.879 -178.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 14' ' ' ALA . 6.9 mp -59.9 -48.84 80.06 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.198 -176.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 p -94.6 -10.61 31.46 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 64.54 18.83 11.57 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.3 0.571 . . . . 0.0 110.884 -178.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.6 t -139.02 144.94 39.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.116 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.41 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.16 134.93 33.47 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 39.1 m-80 -137.0 116.82 13.1 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.151 -174.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -73.34 146.01 45.55 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.86 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.5 m -125.27 124.89 42.63 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.683 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.682 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 38.1 t -117.23 134.27 54.99 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.932 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -114.76 123.54 49.5 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.93 128.64 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.821 0.343 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 68.6 m -144.02 172.29 13.08 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.822 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.46 HD22 HD12 ' A' ' 5' ' ' LEU . 96.5 m-20 60.27 52.19 5.05 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.893 0.746 . . . . 0.0 112.473 171.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.54 ' HA ' HG12 ' A' ' 4' ' ' ILE . 30.9 mt -75.87 153.43 36.78 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.16 177.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 CA-C-O 120.53 0.205 . . . . 0.0 111.236 -177.511 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 . . . . . 0 N--CA 1.449 -0.484 0 N-CA-C 109.082 -0.71 . . . . 0.0 109.082 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.641 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -120.06 135.14 61.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.8 m -124.72 135.01 52.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.828 0.347 . . . . 0.0 110.832 -178.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.451 ' CH2' ' HB2' ' A' ' 85' ' ' CYS . 66.2 m95 -125.83 138.01 53.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.104 174.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.74 158.19 41.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.669 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 t -78.54 160.56 27.57 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -55.54 -32.0 62.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.089 0.471 . . . . 0.0 111.086 -179.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.03 -4.77 43.13 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.425 -178.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.04 22.97 28.71 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.394 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -92.37 122.12 65.17 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -64.78 144.09 82.43 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.772 2.315 . . . . 0.0 112.786 -177.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 49' ' ' LEU . 5.7 mt -120.4 146.39 46.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.41 0.624 . . . . 0.0 111.783 -178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.33 118.2 11.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.936 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.421 HG21 ' HD1' ' A' ' 41' ' ' TRP . 1.8 m . . . . . 0 C--N 1.325 -0.472 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.096 -179.111 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.1 p . . . . . 0 N--CA 1.464 0.258 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -103.21 143.37 32.72 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.478 0.656 . . . . 0.0 111.974 -163.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 97.8 mttt -130.18 139.09 50.88 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.919 177.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.641 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -119.94 115.52 3.01 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.211 176.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -108.2 120.74 60.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.849 0.357 . . . . 0.0 110.209 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.66 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.97 132.45 56.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.905 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.0 m -98.0 118.95 35.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.191 0.52 . . . . 0.0 110.829 -174.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 24' ' ' LEU . 3.4 m -124.43 167.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.152 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.6 t -78.21 149.34 33.69 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -65.48 -27.28 41.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.802 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.12 -35.66 81.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.943 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -65.02 -42.23 94.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -73.8 -36.52 65.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.431 179.214 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 -73.16 -21.15 60.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.913 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -94.96 7.08 47.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.953 0.406 . . . . 0.0 110.209 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.5 ttp180 54.75 39.43 31.36 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.195 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -65.1 164.78 12.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.339 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -108.73 139.2 43.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.616 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.525 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 68.3 m-85 -124.77 148.9 47.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.723 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.1 t -117.6 127.17 75.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.842 -174.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.451 ' HB2' ' CH2' ' A' ' 41' ' ' TRP . 43.8 t -105.44 136.68 44.56 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 97' ' ' LYS . 1.0 OUTLIER -125.93 130.0 50.42 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 178.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.75 124.08 54.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.523 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.28 92.48 3.7 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.74 0.781 . . . . 0.0 110.395 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 10.6 t60 -97.9 -9.22 26.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.294 -179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.33 17.66 11.07 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.542 -174.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -82.99 -27.89 30.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.001 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.52 153.87 77.97 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.177 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.23 -22.78 12.43 Favored 'Trans proline' 0 N--CA 1.465 -0.185 0 C-N-CA 123.076 2.517 . . . . 0.0 112.329 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.403 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 10.6 p -113.82 105.69 54.35 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.432 177.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 30.9 Cg_endo -64.14 141.49 76.47 Favored 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.573 2.182 . . . . 0.0 111.738 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -83.73 128.0 34.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.396 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.537 ' HG2' HG23 ' A' ' 86' ' ' THR . 49.7 mtmt -106.88 139.33 41.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.385 0.612 . . . . 0.0 111.074 178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 42.2 mmtt -118.15 130.71 56.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.686 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -101.45 121.87 42.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.947 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 10' ' ' PRO . 14.0 tt -123.79 139.22 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.114 0.483 . . . . 0.0 110.656 -178.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.1 t -158.1 150.65 22.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.218 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HE2' ' O ' ' A' ' 77' ' ' TRP . 37.2 ttpt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.799 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 . . . . . 0 CA--C 1.515 -0.401 0 N-CA-C 109.922 -0.399 . . . . 0.0 109.922 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.55 HG12 ' HA ' ' A' ' 31' ' ' LEU . 76.1 mt -61.37 126.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.2 mt -104.69 129.74 52.83 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.228 0.537 . . . . 0.0 110.022 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.569 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.2 t -125.24 127.86 47.4 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.72 -179.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -123.91 142.06 51.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.43 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.8 p -113.6 135.0 54.39 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.523 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.14 121.9 31.87 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.1 138.89 34.52 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.665 2.243 . . . . 0.0 111.682 177.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.5 Cg_endo -68.62 146.88 68.71 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.467 2.111 . . . . 0.0 111.523 178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 m -83.14 142.6 31.11 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.118 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -54.02 -43.77 70.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.658 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.88 -40.64 95.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.945 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.21 -39.38 93.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.09 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HG2' ' A' ' 11' ' ' PRO . 71.6 mt -64.55 -32.89 59.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.602 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -71.59 -37.05 71.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.327 -177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 24.2 mt -67.41 -42.68 82.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.852 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.8 p -85.94 -21.28 27.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.427 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 20' ' ' LYS . 27.9 mmtp 66.97 6.19 4.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.213 -175.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.2 p -138.62 125.62 21.25 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.51 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -70.34 138.26 51.28 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.6 p30 -117.27 128.4 55.03 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.229 0.538 . . . . 0.0 110.227 -177.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.711 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 77.7 mt -91.22 122.63 34.01 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.635 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 56.5 m -111.19 123.82 50.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.266 0.555 . . . . 0.0 111.081 -176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.479 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.1 t -117.89 137.21 52.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.559 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -121.56 123.58 42.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 87' ' ' VAL . 22.5 t -117.25 120.6 65.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 p -136.08 176.56 8.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.005 -173.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 12.7 m120 56.98 50.6 11.89 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.763 0.664 . . . . 0.0 111.769 175.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.55 ' HA ' HG12 ' A' ' 4' ' ' ILE . 39.0 mt -74.5 128.91 36.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.683 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.287 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.292 -176.575 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.4 HD22 ' HA ' ' A' ' 38' ' ' ASN . 2.1 t-20 . . . . . 0 N--CA 1.448 -0.568 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.489 HG22 HG21 ' A' ' 51' ' ' THR . 3.0 mp -120.76 135.34 61.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 174.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.3 m -129.6 122.86 29.94 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.658 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.612 ' HD1' HG23 ' A' ' 51' ' ' THR . 79.7 m95 -106.11 136.94 44.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.165 0.507 . . . . 0.0 110.829 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.56 141.0 18.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.87 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 44.6 t -70.57 151.3 45.18 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 175.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -64.57 -21.25 66.65 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.693 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.413 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 3.9 m -75.42 -4.72 41.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.108 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.68 23.16 26.66 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.852 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.548 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 23.7 mt-10 -95.46 120.77 63.2 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 11.8 Cg_exo -70.63 141.99 43.0 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.238 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.5 mt -126.53 141.5 51.85 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.103 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -80.67 107.25 13.32 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.356 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.612 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.6 m . . . . . 0 C--N 1.317 -0.847 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.489 179.894 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 7.1 m . . . . . 0 N--CA 1.451 -0.396 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -115.15 160.56 19.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.936 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -130.46 140.93 50.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . -141.01 124.11 2.48 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.711 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.4 p -119.0 135.98 57.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-O 121.011 0.434 . . . . 0.0 111.354 -174.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.491 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.9 147.87 40.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.708 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.8 m -99.44 114.34 27.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.839 0.352 . . . . 0.0 110.195 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.51 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.8 m -122.34 166.88 16.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.17 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.5 m -86.02 145.52 27.05 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 74' ' ' VAL . 2.4 t -60.06 -33.57 53.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 CA-C-O 121.676 0.751 . . . . 0.0 109.517 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 75' ' ' GLU . 1.8 mp0 -57.1 -37.44 71.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.893 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -62.34 -42.37 99.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.724 0.773 . . . . 0.0 109.015 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.541 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -69.87 -41.01 75.37 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.347 178.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -71.96 -21.79 61.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.481 -178.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -97.53 9.12 43.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.58 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 58.51 36.86 25.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.643 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 81' ' ' LYS . 51.2 mtpt -71.34 162.8 28.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.81 0.338 . . . . 0.0 110.8 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -106.98 137.8 44.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.188 0.518 . . . . 0.0 110.575 -177.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.541 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 76.1 m-85 -125.31 146.34 49.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.692 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 99.5 t -121.17 129.02 76.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.808 -176.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.757 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.2 p -107.11 123.28 48.0 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -112.17 131.1 55.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.107 -178.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 28' ' ' VAL . 40.2 t -105.46 127.33 60.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.989 -176.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.8 p -120.46 90.6 3.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.515 0.674 . . . . 0.0 110.669 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.555 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 11.3 t60 -99.44 -10.17 22.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.658 -175.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.523 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 8.2 tpt180 74.04 0.68 3.68 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.158 0.98 . . . . 0.0 109.853 -174.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.555 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.76 -36.4 65.09 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.286 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.34 154.84 80.71 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.701 -177.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.17 -31.37 12.07 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.929 2.419 . . . . 0.0 112.434 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 21.0 m -112.63 109.17 53.46 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.642 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 86' ' ' THR . 17.8 Cg_endo -59.68 140.27 92.75 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.569 2.179 . . . . 0.0 111.789 -178.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.2 143.49 31.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.452 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -128.59 144.07 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.439 -177.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.757 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 69.6 mmtt -126.28 146.59 49.95 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.197 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.26 129.69 55.5 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 8' ' ' THR . 15.0 tt -131.31 138.73 52.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.84 0.352 . . . . 0.0 110.57 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.3 m -157.14 150.41 23.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.776 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 22.2 tptm . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.661 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 . . . . . 0 CA--C 1.515 -0.39 0 CA-C-O 120.661 0.267 . . . . 0.0 110.428 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.645 HG23 HD23 ' A' ' 31' ' ' LEU . 93.8 mt -84.3 125.63 40.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 174.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' ' 30' ' ' ASN . 1.5 mm? -100.81 130.52 46.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.183 0.516 . . . . 0.0 110.245 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.551 HG21 HG11 ' A' ' 87' ' ' VAL . 23.4 p -117.88 135.45 54.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.025 -178.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -133.43 143.54 48.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.519 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 p -113.84 136.97 52.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.199 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 38.6 mm -117.27 125.03 28.5 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.885 0.374 . . . . 0.0 110.699 -176.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.43 140.15 21.4 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.075 2.517 . . . . 0.0 112.212 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.78 152.11 74.13 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.949 2.432 . . . . 0.0 112.249 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.451 ' HB3' ' OD1' ' A' ' 15' ' ' ASP . 47.9 t -90.98 151.68 20.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.308 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HE1' ' HE3' ' A' ' 102' ' ' LYS . 58.2 m-85 -60.93 -31.86 71.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.242 -174.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.5 75.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.628 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.3 m-20 -74.48 -24.96 59.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.363 0.602 . . . . 0.0 110.72 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 22' ' ' ALA . 69.8 mt -74.48 -25.27 19.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.651 0.739 . . . . 0.0 109.384 172.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -73.7 -47.62 38.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.355 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.766 HD13 ' H ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -77.94 -36.36 49.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.362 0.601 . . . . 0.0 111.547 -169.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.766 ' H ' HD13 ' A' ' 18' ' ' LEU . 24.1 t -89.85 -8.45 51.95 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.988 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.3 mttm 59.07 16.32 4.67 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.015 -178.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.1 m -139.77 152.81 46.89 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.516 ' O ' HG22 ' A' ' 72' ' ' VAL . . . -94.09 122.61 36.78 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.473 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 19.9 m120 -106.28 128.35 53.91 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.429 0.633 . . . . 0.0 111.071 -174.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.576 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 85.9 mt -84.29 138.01 33.15 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.886 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 89.7 m -124.92 117.63 24.49 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.38 0.61 . . . . 0.0 110.497 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.574 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.6 t -109.93 131.99 54.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.417 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.1 tt -126.24 130.67 51.37 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.171 0.51 . . . . 0.0 110.54 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.529 HG12 HD21 ' A' ' 31' ' ' LEU . 44.9 t -122.36 125.28 72.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.754 -178.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . 0.55 ' HB3' ' OG ' ' A' ' 65' ' ' SER . 14.5 p -138.91 176.26 8.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.226 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . 0.483 ' HB2' HD23 ' A' ' 5' ' ' LEU . 3.8 m-20 59.05 46.7 13.0 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.644 0.59 . . . . 0.0 111.041 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.668 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 15.8 mt -79.74 160.23 26.3 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.99 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.446 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 176.059 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.7 t-20 . . . . . 0 N--CA 1.449 -0.489 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 20.2 mm -119.74 135.82 58.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -132.06 135.16 46.28 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.732 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.574 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 56.9 m95 -116.74 138.6 51.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.024 0.44 . . . . 0.0 110.818 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -150.23 162.29 40.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.322 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 36.6 t -74.82 168.07 20.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -63.67 -24.35 67.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.928 0.394 . . . . 0.0 111.391 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.7 m -83.55 3.38 32.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.408 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.48 22.13 54.7 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.861 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 36.3 mt-10 -87.46 121.78 70.98 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -178.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 48.3 Cg_exo -56.38 142.67 88.42 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 123.326 2.684 . . . . 0.0 113.28 -175.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 49' ' ' LEU . 4.5 mt -123.17 146.8 47.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.713 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.63 108.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.96 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.449 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 8.5 m . . . . . 0 C--N 1.322 -0.621 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.145 -177.145 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.55 ' OG ' ' HB3' ' A' ' 29' ' ' SER . 8.2 m . . . . . 0 N--CA 1.45 -0.475 0 CA-C-O 121.278 0.561 . . . . 0.0 112.073 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.539 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.12 150.03 28.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.369 175.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 20.4 ttmm -131.58 139.31 49.16 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -132.92 128.76 5.23 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.61 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.576 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.6 t -114.43 125.01 71.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.728 0.299 . . . . 0.0 111.24 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.473 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -118.44 146.76 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.068 175.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.4 m -100.33 122.29 42.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.825 0.345 . . . . 0.0 110.662 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 22' ' ' ALA . 1.5 m -122.42 167.24 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.36 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -71.76 143.01 49.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.85 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -61.8 -35.25 66.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.818 0.818 . . . . 0.0 108.85 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.89 -32.35 74.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.787 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.02 -47.62 83.93 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.584 ' HH2' HG12 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -67.87 -42.83 80.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.754 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.64 -28.0 68.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.534 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -89.43 7.39 36.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.602 0.239 . . . . 0.0 110.739 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 64.81 37.32 7.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.007 176.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 81' ' ' LYS . 26.7 mmmt -72.44 160.01 33.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.185 178.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -124.06 138.82 54.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.806 -177.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 90.9 m-85 -122.73 160.98 24.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.705 -178.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.1 t -124.62 128.89 73.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.056 0.455 . . . . 0.0 110.854 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.744 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 26.4 p -106.5 142.98 35.27 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.02 176.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -122.48 121.59 36.93 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.255 0.55 . . . . 0.0 110.999 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.551 HG11 HG21 ' A' ' 6' ' ' THR . 0.5 OUTLIER -104.27 134.96 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.353 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.8 92.92 3.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.307 0.575 . . . . 0.0 110.425 -173.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.668 ' CE1' ' HB3' ' A' ' 31' ' ' LEU . 3.2 t-160 -99.03 -10.98 21.92 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.25 9.78 2.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.773 0.797 . . . . 0.0 110.092 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.499 ' HB3' HD11 ' A' ' 4' ' ' ILE . 43.9 t0 -101.7 -23.67 14.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.959 -173.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.498 HD22 ' HG3' ' A' ' 96' ' ' GLN . 0.4 OUTLIER -108.55 160.33 27.58 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.058 179.718 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.13 -32.51 94.72 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.115 1.877 . . . . 0.0 112.826 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.413 ' O ' HD13 ' A' ' 92' ' ' LEU . 23.1 t -153.68 141.7 13.91 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -177.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.92 140.8 47.84 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.011 2.474 . . . . 0.0 111.571 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.498 ' HG3' HD22 ' A' ' 92' ' ' LEU . 41.8 mt-30 -89.68 130.02 36.02 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.805 -175.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 52.3 mtmt -101.9 126.82 48.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.374 176.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.744 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -123.3 141.94 51.46 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.94 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -99.7 142.79 30.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.899 -176.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.584 HG12 ' HH2' ' A' ' 77' ' ' TRP . 13.6 tt -134.87 137.56 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.9 t -157.97 149.84 21.84 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.108 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.562 ' HE3' ' HE1' ' A' ' 13' ' ' PHE . 76.4 tttt . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.495 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 . . . . . 0 CA--C 1.519 -0.246 0 CA-C-O 121.598 0.713 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.636 HG23 HD23 ' A' ' 31' ' ' LEU . 76.2 mt -64.64 122.93 16.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.051 176.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.1 mt -109.48 130.58 55.49 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.93 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.9 t -111.4 133.48 53.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.325 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -125.21 142.27 51.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.725 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.2 p -115.6 136.81 52.7 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.909 0.385 . . . . 0.0 111.129 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.491 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -118.71 125.98 27.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.022 178.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -78.94 139.57 15.46 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.786 2.324 . . . . 0.0 111.622 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -69.96 149.77 66.05 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.573 2.182 . . . . 0.0 111.81 178.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.467 ' O ' HG13 ' A' ' 16' ' ' ILE . 21.8 m -88.26 137.3 32.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.403 -177.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.55 ' HA ' HD12 ' A' ' 16' ' ' ILE . 75.6 t80 -54.18 -37.39 64.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.772 -1.103 . . . . 0.0 112.996 -169.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.38 -46.56 69.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.82 0.343 . . . . 0.0 110.653 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.95 -38.93 93.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.664 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 13' ' ' PHE . 89.1 mt -58.26 -39.85 75.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.798 176.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -69.41 -44.6 71.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.805 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 18' ' ' LEU . 4.4 mm? -69.87 -44.6 69.47 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.331 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -70.8 -7.66 46.87 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.884 -178.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 72.48 -18.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.549 0.739 . . . . 0.0 111.517 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 19' ' ' SER . 57.4 m -138.72 162.35 34.9 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 176.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.563 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -99.19 159.32 15.07 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -128.08 134.54 49.17 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.237 0.542 . . . . 0.0 110.384 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 70.8 mt -88.35 126.04 35.0 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.491 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 62.7 m -111.0 112.32 24.06 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.413 0.625 . . . . 0.0 111.065 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.512 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 37.7 t -111.77 129.12 56.23 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.322 176.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -124.1 123.35 40.13 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 87' ' ' VAL . 12.0 t -118.15 119.95 62.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.426 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.2 t -135.04 178.2 7.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.33 -174.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.8 41.86 20.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.345 0.593 . . . . 0.0 110.764 -176.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.636 HD23 HG23 ' A' ' 4' ' ' ILE . 43.4 mt -70.38 126.14 28.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.745 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.352 -175.716 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.1 t30 . . . . . 0 N--CA 1.451 -0.425 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.577 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.0 mm -121.08 140.29 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -142.19 135.68 29.18 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 122.019 -0.426 . . . . 0.0 111.456 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.521 ' HD1' HG21 ' A' ' 51' ' ' THR . 67.6 m95 -119.21 149.88 41.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.888 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.45 144.67 18.46 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.192 175.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -65.09 163.17 15.4 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.351 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 31.1 tt0 -53.43 -31.6 46.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.228 0.537 . . . . 0.0 110.941 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.8 t -72.87 -0.68 14.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.075 -178.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.51 17.77 67.82 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.57 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.477 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 52.5 mt-10 -93.99 127.86 43.52 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -176.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.7 Cg_exo -57.97 136.32 74.36 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 123.036 2.491 . . . . 0.0 112.911 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.688 HD12 ' HB1' ' A' ' 70' ' ' ALA . 0.3 OUTLIER -97.69 146.84 24.94 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.915 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 6.8 tp10 -67.31 104.67 1.55 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.521 HG21 ' HD1' ' A' ' 41' ' ' TRP . 1.7 m . . . . . 0 C--N 1.311 -1.072 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.287 -177.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.8 p . . . . . 0 N--CA 1.453 -0.317 0 N-CA-C 112.976 0.732 . . . . 0.0 112.976 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.84 148.2 28.82 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.92 171.085 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HE2' HG23 ' A' ' 25' ' ' THR . 63.5 tttm -132.31 139.23 48.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -175.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.577 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.97 133.98 7.81 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.782 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 45.7 t -114.49 124.21 70.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.688 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -114.85 155.98 25.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.4 179.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 m -108.41 121.35 44.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.673 0.273 . . . . 0.0 110.998 -172.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.563 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 4.2 m -128.34 153.35 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.211 0.529 . . . . 0.0 110.115 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 m -77.5 145.93 36.71 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.994 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.414 HG22 HG22 ' A' ' 16' ' ' ILE . 25.9 t -58.03 -33.57 46.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.463 0.649 . . . . 0.0 109.663 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -57.63 -42.34 83.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.222 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -67.58 -41.35 84.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.684 ' CD1' ' HG2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -68.98 -35.14 76.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.185 179.468 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -69.62 -26.28 64.36 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.052 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -91.51 7.1 42.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.028 0.442 . . . . 0.0 110.004 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 60.02 39.13 20.27 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.582 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 81' ' ' LYS . 3.2 mmpt? -56.67 147.45 22.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.962 174.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.455 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -115.0 139.33 49.94 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.882 178.042 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -125.5 158.09 35.36 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.524 -176.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 76.6 t -123.06 125.52 72.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.575 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.8 p -105.76 135.44 47.17 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.2 OUTLIER -125.31 136.29 53.33 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 28' ' ' VAL . 28.8 t -110.57 127.72 67.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.829 0.347 . . . . 0.0 111.154 -175.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 p -114.85 90.17 3.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.418 0.628 . . . . 0.0 111.409 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -98.66 -15.41 19.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.667 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 90' ' ' ARG . 0.1 OUTLIER 64.12 24.02 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.486 -178.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -98.91 -36.51 9.74 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.51 0.671 . . . . 0.0 109.462 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -100.08 148.03 34.29 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.808 172.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.53 -22.48 38.45 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.269 2.646 . . . . 0.0 112.884 -172.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' HD13 ' A' ' 92' ' ' LEU . 14.3 m -132.88 130.07 21.4 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 24.5 Cg_exo -62.56 141.0 84.59 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.464 2.109 . . . . 0.0 112.139 -178.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.4 pt20 -87.99 142.01 28.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.395 -178.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 20.1 ptmt -127.17 148.47 50.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.225 0.536 . . . . 0.0 111.209 -175.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 61.6 mmtt -134.15 145.6 49.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.611 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.48 ' CD1' HG22 ' A' ' 84' ' ' VAL . 34.3 m-85 -105.7 142.69 35.01 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 9.7 tt -142.38 138.12 29.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.766 0.317 . . . . 0.0 111.191 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 p -158.34 148.66 20.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.684 ' HG2' ' CD1' ' A' ' 77' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.822 -0.609 . . . . 0.0 110.022 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 . . . . . 0 CA--C 1.517 -0.299 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.611 HG12 ' HA ' ' A' ' 31' ' ' LEU . 64.5 mt -59.61 121.65 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -103.98 131.05 51.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.515 -176.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.475 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 11.6 p -117.5 122.17 42.97 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.427 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -133.92 145.41 49.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.034 0.445 . . . . 0.0 110.406 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.8 p -115.41 135.91 53.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.317 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.15 121.82 31.96 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.543 ' HA ' HD11 ' A' ' 100' ' ' ILE . 59.4 Cg_endo -70.44 140.01 39.15 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.751 2.301 . . . . 0.0 111.654 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HG2' HD11 ' A' ' 16' ' ' ILE . 66.1 Cg_endo -68.88 144.96 60.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.26 1.973 . . . . 0.0 110.806 176.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -79.2 138.15 37.72 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -54.05 -42.59 69.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.72 0.295 . . . . 0.0 111.287 -170.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.4 -38.25 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.339 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -66.27 -35.9 81.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.059 0.457 . . . . 0.0 110.349 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.479 HD11 ' HG2' ' A' ' 11' ' ' PRO . 53.7 mt -67.36 -32.04 55.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.01 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -66.49 -36.94 83.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.652 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.0 mt -76.82 -48.01 19.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.006 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.7 m -80.53 -10.35 59.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.408 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 63.2 mmtt 71.05 -57.09 0.61 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.557 0.743 . . . . 0.0 111.739 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 20.0 m -95.08 127.17 40.93 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 176.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.541 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -60.97 145.53 50.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.777 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -120.62 124.53 45.48 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.302 0.572 . . . . 0.0 110.558 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 83.5 mt -83.36 130.52 35.06 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.807 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 m -115.26 122.76 46.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.183 0.516 . . . . 0.0 111.139 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.409 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.9 t -111.27 138.47 47.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.723 -178.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -126.19 122.45 35.67 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 t -127.86 120.83 54.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 t -137.43 177.08 8.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.5 -173.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.6 35.8 24.74 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.116 0.566 . . . . 0.0 112.048 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.611 ' HA ' HG12 ' A' ' 4' ' ' ILE . 48.9 mt -60.07 124.95 21.82 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.331 -0.2 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -170.316 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.6 m120 . . . . . 0 N--CA 1.445 -0.679 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.3 mm -120.43 135.82 59.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 m -139.27 125.84 20.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.077 0.465 . . . . 0.0 111.531 -176.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.546 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 85.8 m95 -106.81 148.2 28.79 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.122 174.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.0 156.13 36.83 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 22.8 m -87.84 156.8 19.21 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -60.24 -19.98 56.9 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -72.76 -7.35 50.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.211 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.8 18.24 41.44 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.041 176.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 13.2 pt-20 -101.81 133.9 20.48 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 120.507 0.194 . . . . 0.0 110.745 -177.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 12.1 Cg_exo -69.78 136.79 33.81 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.676 2.251 . . . . 0.0 112.416 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.0 mt -106.08 142.02 36.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.62 177.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -64.57 106.72 1.21 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.938 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 12.2 m . . . . . 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.804 178.83 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.5 p . . . . . 0 N--CA 1.449 -0.511 0 CA-C-O 121.659 0.742 . . . . 0.0 112.885 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.71 148.34 30.61 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.112 167.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -131.48 140.64 49.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.69 127.49 4.11 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.608 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.581 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 43.3 t -115.08 128.29 72.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.759 0.314 . . . . 0.0 110.596 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -116.53 148.64 40.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.69 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 m -99.93 124.1 44.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.266 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.541 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.6 m -119.73 166.96 13.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.471 ' HB3' ' OD2' ' A' ' 76' ' ' ASP . 23.2 t -86.68 154.29 21.1 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.193 -178.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.37 -39.66 85.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.076 0.465 . . . . 0.0 110.67 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -58.36 -36.24 73.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.789 -178.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 73' ' ' SER . 13.3 m-20 -63.94 -45.02 91.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.335 0.588 . . . . 0.0 110.094 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.457 ' HE1' ' HD2' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.5 -35.07 68.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.196 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -65.76 -30.22 70.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.235 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . 0.401 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 95.3 m-20 -90.85 7.27 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.096 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 57.89 36.77 26.6 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.387 0.43 . . . . 0.0 110.912 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 31.6 mmmt -68.93 163.31 24.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.336 -177.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 51.3 mt-10 -114.69 139.75 49.41 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.507 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 99' ' ' PHE . 75.1 m-85 -121.14 157.29 30.47 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.792 177.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 93.5 t -120.75 129.0 76.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 0.0 110.967 -176.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.546 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 34.9 t -106.18 127.62 53.34 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.12 126.16 52.38 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 54.1 t -105.9 125.67 61.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.143 0.497 . . . . 0.0 111.1 -177.147 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.1 p -120.56 103.9 9.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.731 ' ND1' ' HB2' ' A' ' 91' ' ' ASP . 39.6 t-80 -98.39 -20.37 17.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.048 -176.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.509 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 18.9 ttt180 74.04 8.13 4.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.008 0.908 . . . . 0.0 108.786 -169.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.731 ' HB2' ' ND1' ' A' ' 89' ' ' HIS . 11.2 t0 -93.58 -36.41 12.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.773 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.419 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.7 OUTLIER -119.32 151.96 51.88 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.319 178.501 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.58 -31.33 11.05 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 123.017 2.478 . . . . 0.0 112.801 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.3 m -116.77 111.54 41.17 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.168 -176.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.91 141.25 83.63 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.257 1.971 . . . . 0.0 111.939 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -86.43 127.4 34.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -112.76 128.31 56.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.305 178.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 64.5 mmtt -122.77 149.32 44.27 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.023 -174.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . 0.419 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.4 m-85 -105.73 146.79 29.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.966 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.8 tt -136.34 138.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.265 175.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.428 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 10.7 t -158.85 149.92 20.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.523 177.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.821 ' HA ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.558 -0.735 . . . . 0.0 110.321 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 . . . . . 0 C--O 1.234 0.25 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.592 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.1 mt -70.7 123.12 24.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.264 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.1 mt -104.95 131.03 52.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.009 0.433 . . . . 0.0 110.345 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.415 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 13.9 p -109.42 123.48 49.42 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.843 -179.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -119.32 131.39 55.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 3.2 p -119.51 131.57 55.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.369 176.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.88 124.48 28.75 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.975 0.417 . . . . 0.0 110.495 -178.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.41 140.73 24.69 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.886 2.391 . . . . 0.0 111.507 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.551 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 51.8 Cg_endo -64.85 147.41 89.44 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.578 2.185 . . . . 0.0 111.845 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.403 ' O ' HG13 ' A' ' 16' ' ' ILE . 10.7 p -89.56 146.44 24.58 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.136 -177.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . 0.83 ' HE1' ' HE2' ' A' ' 102' ' ' LYS . 47.9 m-85 -59.76 -31.39 69.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.446 -174.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.15 76.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.563 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.02 -35.07 66.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.502 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 12' ' ' SER . 83.1 mt -63.46 -32.02 55.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.461 176.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -62.99 -43.93 97.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.405 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.98 -47.87 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.422 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.6 m -70.69 -24.24 62.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.972 -177.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt 70.94 -6.07 1.36 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.496 0.718 . . . . 0.0 111.368 -177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 71.3 p -137.9 161.99 35.2 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.73 32.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -125.88 130.26 50.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.986 0.422 . . . . 0.0 110.057 -177.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 88.6 mt -86.29 128.91 34.99 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.45 -176.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . 0.409 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 18.2 m -109.05 114.4 28.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.504 -178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.597 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 25.3 t -114.05 134.82 54.61 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.117 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -135.97 129.11 31.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.142 0.496 . . . . 0.0 110.109 175.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.466 HG11 HG11 ' A' ' 87' ' ' VAL . 15.4 t -123.35 132.87 70.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -143.3 171.84 13.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.156 0.503 . . . . 0.0 111.557 -173.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 64.51 48.95 2.53 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.173 169.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.592 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -72.79 157.17 38.0 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.098 -1.41 . . . . 0.0 109.122 178.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.322 -0.6 0 CA-C-O 120.881 0.372 . . . . 0.0 110.926 -179.81 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.9 t-20 . . . . . 0 N--CA 1.455 -0.222 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.729 HG21 ' HA3' ' A' ' 68' ' ' GLY . 17.5 mm -121.14 136.05 59.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 t -145.67 128.58 16.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.896 0.379 . . . . 0.0 110.863 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.597 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 55.2 m95 -108.7 149.03 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.474 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.55 163.81 38.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.622 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 t -84.68 168.69 15.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' GLU . 56.4 tt0 -57.37 -29.18 63.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.086 0.47 . . . . 0.0 110.85 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -73.66 -4.3 33.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.526 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.1 20.79 54.52 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.812 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.8 mt-10 -99.64 123.6 47.29 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 32.2 Cg_exo -58.66 137.55 80.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.154 2.569 . . . . 0.0 113.217 -173.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -106.34 148.35 28.14 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.664 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.514 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 39.4 mm-40 -62.71 106.59 0.82 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.808 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . 0.529 HG23 ' HD1' ' A' ' 41' ' ' TRP . 3.1 m . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.874 -177.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.235 0.312 0 CA-C-O 121.669 0.747 . . . . 0.0 112.859 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.432 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.54 158.51 17.94 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.287 175.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -134.23 140.43 46.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.747 0.308 . . . . 0.0 110.462 -176.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.729 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -139.43 138.69 9.45 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -123.2 129.0 75.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.802 0.334 . . . . 0.0 110.78 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.61 150.49 37.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.406 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.4 m -102.63 119.85 39.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.8 m -127.19 166.4 23.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.977 0.418 . . . . 0.0 110.779 -176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.566 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.8 m -85.16 137.62 32.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.271 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -65.67 -24.98 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.436 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.2 -33.95 76.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.034 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . 0.566 ' OD1' ' HB2' ' A' ' 73' ' ' SER . 3.5 m-20 -66.11 -41.32 90.71 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.551 ' CZ2' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -65.86 -41.33 91.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.072 177.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.28 -30.07 69.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.995 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -91.38 8.01 38.28 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.214 -0.195 . . . . 0.0 111.061 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.97 37.26 21.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.467 -178.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -67.2 161.83 23.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.05 0.453 . . . . 0.0 110.146 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 45.8 mt-10 -112.65 140.53 47.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.42 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.9 m-85 -121.32 149.69 42.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.482 176.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 90.2 t -123.01 120.33 60.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.083 -173.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.7 p -105.67 135.32 47.3 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 95' ' ' PRO . 1.2 m -122.38 132.94 54.62 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.775 0.322 . . . . 0.0 110.156 -177.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.466 HG11 HG11 ' A' ' 28' ' ' VAL . 44.3 t -109.1 126.99 66.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.766 -178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -117.8 88.5 2.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.59 0.709 . . . . 0.0 111.58 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.526 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 23.5 t60 -98.82 -6.89 28.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.514 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 0.1 OUTLIER 52.29 24.09 2.7 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.901 -175.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.411 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 29.0 t70 -94.05 -28.51 15.69 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.562 -179.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -118.23 156.07 51.01 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.049 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.52 -21.86 39.4 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.056 2.504 . . . . 0.0 113.106 -175.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.498 ' O ' HD13 ' A' ' 92' ' ' LEU . 37.5 p -134.63 125.0 17.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.499 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HB2' HG22 ' A' ' 86' ' ' THR . 18.0 Cg_endo -61.35 141.38 92.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.585 2.19 . . . . 0.0 111.412 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 86' ' ' THR . 33.2 mt-30 -80.58 126.73 31.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.964 0.411 . . . . 0.0 111.148 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -107.36 126.71 52.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.368 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.663 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 16.7 mmtt -115.27 133.78 55.73 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.967 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.21 122.75 44.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.799 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 12.5 tt -122.17 139.89 47.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.159 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -157.28 150.01 23.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.047 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.83 ' HE2' ' HE1' ' A' ' 13' ' ' PHE . 47.7 tttm . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.813 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 . . . . . 0 CA--C 1.517 -0.324 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.6 HG23 HD23 ' A' ' 31' ' ' LEU . 73.5 mt -60.4 121.49 8.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.228 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.31 138.32 43.72 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.257 -176.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 28' ' ' VAL . 2.2 p -115.05 120.07 38.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.858 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -119.36 132.01 55.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 p -115.63 132.48 56.62 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.258 176.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.96 125.92 27.64 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.81 0.338 . . . . 0.0 110.427 -177.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PRO . . . . . 0.47 ' HA ' HD11 ' A' ' 100' ' ' ILE . 55.9 Cg_endo -70.75 139.59 37.1 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.612 2.208 . . . . 0.0 111.444 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.499 ' HG2' HD11 ' A' ' 16' ' ' ILE . 55.7 Cg_endo -68.81 154.96 70.18 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.736 2.29 . . . . 0.0 112.447 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.438 ' O ' HG13 ' A' ' 16' ' ' ILE . 11.9 p -84.82 126.09 33.15 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 -177.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -61.4 -30.83 70.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.554 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -62.18 -40.28 95.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 177.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.04 -43.14 58.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.903 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.499 HD11 ' HG2' ' A' ' 11' ' ' PRO . 76.5 mt -57.69 -32.69 43.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.469 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.08 -39.0 93.41 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.43 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 41.1 mt -72.6 -48.14 42.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.557 -173.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.8 p -86.46 -18.16 32.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.865 0.364 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm 68.87 16.12 8.87 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.734 0.813 . . . . 0.0 110.117 -174.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -135.35 128.88 32.53 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.314 -176.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.14 136.61 32.86 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.613 176.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 48.8 m-80 -122.93 125.9 46.21 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.147 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 70.9 mt -83.46 131.08 35.04 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.003 -178.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.2 m -119.07 121.19 39.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.286 0.565 . . . . 0.0 110.949 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' CYS . . . . . 0.584 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.4 t -126.88 137.97 53.24 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.171 178.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 3.9 tt -133.5 132.9 41.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.009 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 87' ' ' VAL . 43.6 t -115.12 118.52 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.864 -178.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.9 p -121.2 178.57 4.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.869 -169.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 59.17 35.88 23.76 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.464 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.6 HD23 HG23 ' A' ' 4' ' ' ILE . 9.7 mt -71.79 123.64 23.08 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.307 0 CA-C-O 121.143 0.496 . . . . 0.0 110.922 -178.96 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 9.9 t30 . . . . . 0 N--CA 1.448 -0.543 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ILE . . . . . 0.509 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.2 mm -120.08 134.41 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 m -129.32 133.84 47.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.041 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' TRP . . . . . 0.584 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 79.6 m95 -111.77 146.59 37.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.23 174.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.07 164.39 38.1 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.927 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.4 t -73.8 167.17 21.96 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 84' ' ' VAL . 35.9 tt0 -59.78 -31.22 69.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.008 0.432 . . . . 0.0 110.841 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.427 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 18.4 m -75.11 -6.81 51.52 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.35 19.69 37.77 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.295 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 6.6 mm-40 -81.77 122.42 80.25 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 23.3 Cg_exo -62.38 135.8 55.85 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.546 2.164 . . . . 0.0 113.352 -172.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 49' ' ' LEU . 7.6 mt -105.91 148.36 27.71 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.217 177.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.65 106.33 2.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.419 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 18.1 m . . . . . 0 C--N 1.32 -0.675 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.824 -178.759 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.52 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 5.5 m . . . . . 0 N--CA 1.451 -0.414 0 CA-C-O 121.071 0.463 . . . . 0.0 111.622 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . 0.427 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.49 160.96 15.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.785 177.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.3 ttmt -130.59 139.11 50.41 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLY . . . . . 0.509 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -126.36 119.65 3.47 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.471 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 46.6 t -108.48 123.98 64.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.808 0.337 . . . . 0.0 110.818 -177.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.98 137.15 52.37 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.081 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.7 m -98.99 116.09 30.44 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.238 0.542 . . . . 0.0 110.144 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' VAL . . . . . 0.416 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.3 m -120.34 166.82 14.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.692 -177.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 m -75.95 134.19 40.27 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.6 p -53.02 -34.07 20.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -56.83 -40.81 76.71 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.456 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -67.24 -44.67 78.84 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.476 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -63.5 -42.01 98.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.824 176.643 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ASN . . . . . 0.6 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 7.5 t30 -73.11 -11.71 60.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.988 -176.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -107.18 12.61 28.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 65.74 37.85 5.53 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.783 176.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -76.84 152.72 35.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.115 0.483 . . . . 0.0 111.545 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 42.6 mt-10 -109.35 138.82 45.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.252 177.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -125.37 151.92 45.47 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.02 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 88.2 t -116.54 129.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.38 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' CYS . . . . . 0.675 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 43.3 t -105.89 131.87 52.69 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' THR . . . . . 0.549 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -125.99 137.34 53.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -128.29 133.46 66.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.197 0.522 . . . . 0.0 112.139 -173.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -114.93 100.44 8.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.681 -177.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' HIS . . . . . 0.442 ' C ' ' H ' ' A' ' 91' ' ' ASP . 18.5 t60 -99.79 -11.03 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.696 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 50.0 ttt180 74.06 -24.05 0.21 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.045 0.538 . . . . 0.0 111.116 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 89' ' ' HIS . 39.0 t70 -71.97 -31.88 66.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.158 0.504 . . . . 0.0 110.46 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.78 152.22 42.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.747 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.29 -21.87 10.09 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.192 2.595 . . . . 0.0 113.249 -176.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 57.4 p -125.76 114.95 24.71 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.453 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' PRO . . . . . 0.549 ' HB2' HG22 ' A' ' 86' ' ' THR . 16.3 Cg_endo -58.25 141.87 97.02 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 111.228 176.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLN . . . . . 0.511 ' O ' ' HA ' ' A' ' 86' ' ' THR . 44.4 mt-30 -91.19 128.47 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.761 -173.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.675 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.6 ptmt -111.52 130.19 55.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.211 0.529 . . . . 0.0 110.827 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 68.1 mmtt -121.56 152.91 38.71 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.733 -177.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.5 130.48 55.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 10' ' ' PRO . 16.0 tt -126.84 144.12 38.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' SER . . . . . 0.556 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 29.5 t -156.77 151.0 25.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.503 -175.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 13.8 tmtt? . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.725 -0.655 . . . . 0.0 110.078 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.8 mtt . . . . . 0 N--CA 1.478 0.973 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 73.39 18.07 79.19 Favored Glycine 0 C--O 1.229 -0.204 0 C-N-CA 121.108 -0.568 . . . . 0.0 112.845 177.661 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -154.5 120.84 5.36 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.528 HG23 HD23 ' A' ' 31' ' ' LEU . 67.7 mt -75.67 122.2 29.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 CA-C-O 121.119 0.485 . . . . 0.0 111.883 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.445 HD23 ' HE2' ' A' ' 7' ' ' PHE . 11.1 mp -103.97 131.57 51.08 Favored 'General case' 0 N--CA 1.443 -0.775 0 CA-C-N 115.528 -0.76 . . . . 0.0 111.276 179.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.463 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 6.7 t -124.42 127.64 47.84 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 114.661 -1.154 . . . . 0.0 110.521 176.603 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.445 ' HE2' HD23 ' A' ' 5' ' ' LEU . 93.5 m-85 -138.0 148.7 45.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.621 -0.718 . . . . 0.0 109.52 177.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 9.7 p -112.35 141.57 45.92 Favored 'General case' 0 C--N 1.316 -0.881 0 CA-C-O 120.738 0.304 . . . . 0.0 110.714 -179.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 43.3 mm -117.15 122.74 30.82 Favored Pre-proline 0 C--N 1.321 -0.646 0 CA-C-O 121.114 0.483 . . . . 0.0 110.361 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -79.25 143.59 17.69 Favored 'Trans proline' 0 N--CA 1.458 -0.581 0 C-N-CA 123.013 2.475 . . . . 0.0 111.754 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.68 141.84 38.58 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 121.988 1.792 . . . . 0.0 110.328 175.151 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.412 ' O ' HG13 ' A' ' 16' ' ' ILE . 1.9 m -80.05 156.22 27.2 Favored 'General case' 0 C--N 1.314 -0.941 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.36 -174.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -53.99 -42.91 69.53 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.779 0.323 . . . . 0.0 110.266 179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.695 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -61.68 -45.7 92.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.925 -0.579 . . . . 0.0 111.191 177.759 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 74.1 m-20 -62.28 -44.47 96.45 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 120.972 0.415 . . . . 0.0 110.776 -176.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.412 HG13 ' O ' ' A' ' 12' ' ' SER . 54.8 mt -65.52 -29.44 47.11 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.54 179.595 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.3 t80 -71.49 -39.71 70.67 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.315 -179.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.695 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 20.7 mt -67.0 -48.41 68.5 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.702 -0.681 . . . . 0.0 111.093 -176.324 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -89.52 -23.11 22.12 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.907 -0.588 . . . . 0.0 111.163 -175.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 31.8 mmtp 64.04 19.22 11.66 Favored 'General case' 0 N--CA 1.463 0.208 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.963 -175.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 72.4 m -137.74 134.24 35.08 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.923 -1.035 . . . . 0.0 108.895 174.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.38 141.36 30.05 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 109.551 -0.537 . . . . 0.0 109.551 178.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 10.0 p30 -127.27 137.41 52.84 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.149 0.499 . . . . 0.0 109.899 -176.265 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.454 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 84.6 mt -95.86 126.52 41.18 Favored 'General case' 0 C--N 1.312 -1.022 0 CA-C-N 115.639 -0.71 . . . . 0.0 109.687 178.58 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 63.7 m -120.05 132.47 55.47 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.835 -178.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.47 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 39.7 t -123.1 137.39 54.93 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.789 -0.642 . . . . 0.0 109.73 178.327 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 27' ' ' LEU . 2.5 tm? -117.55 123.19 45.64 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.17 -0.678 . . . . 0.0 109.17 179.247 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 87' ' ' VAL . 22.7 t -122.56 119.63 58.69 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.44 0 CA-C-N 116.368 -0.378 . . . . 0.0 110.036 179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 9.2 t -137.15 178.75 6.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 116.272 -0.422 . . . . 0.0 110.611 -172.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 61.08 30.19 19.33 Favored 'General case' 0 N--CA 1.465 0.323 0 O-C-N 123.691 0.619 . . . . 0.0 111.742 177.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 37' ' ' LEU . 44.3 mt -62.15 126.31 26.9 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 179.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -65.48 -26.84 68.11 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.336 0.589 . . . . 0.0 110.154 -179.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 18.0 p -127.77 94.95 4.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.285 178.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -77.43 63.93 2.69 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.3 0.571 . . . . 0.0 111.287 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.424 ' O ' ' HG3' ' A' ' 57' ' ' GLU . 6.9 tt0 -99.76 -80.92 0.47 Allowed 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.018 177.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 17.7 p -132.97 161.48 34.21 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.019 -0.537 . . . . 0.0 109.664 178.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 31' ' ' LEU . 63.9 tp -156.15 147.48 22.51 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.069 0.461 . . . . 0.0 110.996 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -127.45 152.75 47.14 Favored 'General case' 0 C--N 1.321 -0.652 0 CA-C-N 115.312 -0.858 . . . . 0.0 109.715 179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.488 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.8 mm -120.95 137.13 55.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 178.049 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 25.4 m -130.12 130.03 44.28 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 120.764 0.316 . . . . 0.0 111.226 -179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.544 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 70.9 m95 -117.31 141.91 47.73 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.523 175.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.38 156.3 40.43 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.96 -0.564 . . . . 0.0 109.631 -179.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.465 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 19.6 m -74.98 158.84 32.59 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 174.865 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 tt0 -54.08 -30.85 49.9 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.047 0.451 . . . . 0.0 111.277 -177.291 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.4 m -73.4 -1.56 18.76 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.96 -178.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 87.84 21.37 47.02 Favored Glycine 0 N--CA 1.453 -0.205 0 C-N-CA 120.934 -0.65 . . . . 0.0 112.073 179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.408 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 37.9 mt-10 -99.95 122.04 52.07 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 109.995 -0.372 . . . . 0.0 109.995 -178.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.408 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.6 Cg_exo -58.67 137.9 82.72 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.859 2.373 . . . . 0.0 112.385 -176.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.426 ' HA ' HD23 ' A' ' 49' ' ' LEU . 10.9 mt -103.51 146.55 28.36 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.99 -178.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.79 105.87 0.5 Allowed 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 110.227 175.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.9 m -120.83 136.58 54.88 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 0.0 109.658 -176.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 43.7 mmtm -119.41 123.0 43.03 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.414 0.626 . . . . 0.0 110.478 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.442 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 54.1 mt -133.67 127.89 53.47 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 CA-C-N 114.713 -1.13 . . . . 0.0 109.972 -175.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.49 ' HG3' HG23 ' A' ' 55' ' ' VAL . 20.6 tptm -97.09 122.87 40.57 Favored 'General case' 0 C--N 1.319 -0.755 0 C-N-CA 120.675 -0.41 . . . . 0.0 109.914 177.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.778 HG12 ' H ' ' A' ' 57' ' ' GLU . 41.5 t 80.16 123.6 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 CA-C-N 115.113 -0.949 . . . . 0.0 110.967 -179.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 4.4 ppp? -81.0 10.93 4.45 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.712 0.768 . . . . 0.0 110.819 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.778 ' H ' HG12 ' A' ' 55' ' ' VAL . 36.8 tt0 -122.52 154.07 38.35 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.108 -0.951 . . . . 0.0 108.571 -178.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.9 p -75.75 145.98 40.41 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 -176.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.443 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 16.3 m170 -91.78 127.59 49.42 Favored Pre-proline 0 C--N 1.326 -0.452 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 -171.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.443 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 97.7 Cg_endo -103.87 22.46 0.13 Allowed 'Trans proline' 0 N--CA 1.45 -1.042 0 C-N-CA 123.762 2.975 . . . . 0.0 113.006 178.702 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -112.99 115.84 29.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.433 -0.349 . . . . 0.0 110.103 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.6 -53.96 4.32 Favored Glycine 0 CA--C 1.517 0.178 0 C-N-CA 121.006 -0.616 . . . . 0.0 111.669 -176.225 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 5.5 m -123.29 168.71 12.13 Favored 'General case' 0 C--N 1.318 -0.804 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 175.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -115.75 24.47 11.49 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.371 0.605 . . . . 0.0 110.127 178.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 15.4 m -119.5 170.92 8.73 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.644 -172.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.53 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -110.52 151.65 27.33 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.623 -0.717 . . . . 0.0 109.476 171.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.47 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.4 mtmt -131.63 140.49 49.39 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.078 0.466 . . . . 0.0 110.153 174.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.488 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -117.19 125.92 6.73 Favored Glycine 0 N--CA 1.439 -1.16 0 N-CA-C 110.479 -1.049 . . . . 0.0 110.479 174.362 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.454 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 54.2 t -108.63 120.84 60.74 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 CA-C-O 120.818 0.342 . . . . 0.0 110.426 -178.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.434 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -114.46 140.17 48.93 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 116.129 -0.487 . . . . 0.0 109.895 178.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 15.3 m -99.39 115.03 28.3 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.152 0.501 . . . . 0.0 110.445 -176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 3.2 m -119.69 166.95 13.6 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 115.72 -0.673 . . . . 0.0 110.053 -177.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.404 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 21.6 m -82.11 137.26 35.04 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 109.615 -0.513 . . . . 0.0 109.615 -179.003 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 23.4 t -56.96 -28.54 29.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.654 -0.703 . . . . 0.0 109.917 177.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.42 ' H ' ' HG3' ' A' ' 75' ' ' GLU . 23.6 mt-10 -56.99 -42.2 79.82 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.621 176.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.404 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 46.1 m-20 -63.08 -47.85 81.15 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.266 0.555 . . . . 0.0 109.904 -178.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.427 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -63.56 -39.0 93.25 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.397 -0.82 . . . . 0.0 110.328 177.766 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 59.4 m-20 -69.45 -28.65 66.3 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.76 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -94.48 12.64 26.59 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 120.603 0.24 . . . . 0.0 111.131 -178.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 12.6 mmm180 64.7 36.87 7.92 Favored 'General case' 0 C--O 1.232 0.169 0 CA-C-N 116.031 -0.532 . . . . 0.0 111.283 175.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -75.81 163.74 26.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.038 0.447 . . . . 0.0 110.539 177.859 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -130.71 139.34 50.29 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.734 -0.667 . . . . 0.0 109.595 -179.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.465 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 83.9 m-85 -121.52 162.04 21.24 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.215 -178.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.417 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 75.0 t -122.94 126.54 73.92 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.573 0 CA-C-O 120.99 0.424 . . . . 0.0 111.073 -175.619 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.544 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 48.5 t -106.4 136.89 45.36 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.036 -0.728 . . . . 0.0 109.036 173.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.477 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -124.36 129.57 50.94 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 177.767 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.465 HG11 HG11 ' A' ' 28' ' ' VAL . 38.9 t -102.27 126.63 56.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 C-N-CA 120.597 -0.441 . . . . 0.0 110.668 -178.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 21.1 p -117.43 93.58 4.22 Favored 'General case' 0 N--CA 1.449 -0.523 0 CA-C-O 121.473 0.654 . . . . 0.0 110.673 -178.365 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.534 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 74.8 t60 -99.46 -7.13 26.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.181 -177.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 89' ' ' HIS . 37.6 ptt85 65.08 -11.79 0.14 Allowed 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 125.476 1.51 . . . . 0.0 112.537 -174.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.534 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 16.0 t70 -76.27 -33.95 59.13 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.467 0.651 . . . . 0.0 110.304 -174.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -98.89 153.68 37.73 Favored Pre-proline 0 C--N 1.322 -0.592 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.564 179.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -76.23 -23.63 11.67 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 123.083 2.522 . . . . 0.0 112.55 -178.391 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.487 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 15.9 m -132.02 114.78 15.19 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.917 -179.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.487 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 14.3 Cg_endo -56.84 141.15 92.88 Favored 'Trans proline' 0 C--N 1.348 0.519 0 C-N-CA 122.933 2.422 . . . . 0.0 111.913 178.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -89.65 127.1 35.87 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.458 -178.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.9 ptpt -108.22 140.76 40.99 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.966 -0.561 . . . . 0.0 110.359 177.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.463 ' HE3' ' O ' ' A' ' 6' ' ' THR . 62.3 mmtt -127.37 139.97 52.5 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.978 -178.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -101.67 136.99 40.57 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.709 178.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.9 tt -131.38 138.87 52.15 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.866 0.365 . . . . 0.0 110.956 -178.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 41.6 t -154.53 149.99 27.3 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.581 -178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.427 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 53.4 tttm . . . . . 0 C--O 1.248 1.011 0 CA-C-O 118.387 -0.816 . . . . 0.0 110.452 -179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.747 0.308 . . . . 0.0 110.48 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.25 60.55 0.41 Allowed Glycine 0 N--CA 1.447 -0.618 0 N-CA-C 111.5 -0.64 . . . . 0.0 111.5 179.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -113.64 120.27 40.31 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 -178.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.569 HG12 ' HA ' ' A' ' 31' ' ' LEU . 54.4 mt -60.28 126.93 18.92 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.229 0 N-CA-C 110.134 -0.321 . . . . 0.0 110.134 177.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 80.0 mt -104.36 130.92 52.19 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.164 0.507 . . . . 0.0 110.673 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 3.2 p -112.56 119.46 38.22 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.066 -178.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.574 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 58.1 m-85 -119.77 135.37 54.87 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.148 -0.478 . . . . 0.0 109.722 179.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.4 p -113.67 132.43 55.79 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 120.818 0.342 . . . . 0.0 110.533 177.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.1 mp -117.64 124.79 28.58 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.189 -177.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -66.31 140.44 58.5 Favored 'Trans proline' 0 N--CA 1.46 -0.48 0 C-N-CA 122.775 2.317 . . . . 0.0 111.518 175.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HB2' HD11 ' A' ' 16' ' ' ILE . 18.2 Cg_endo -59.05 162.03 14.59 Favored 'Trans proline' 0 C--O 1.233 0.257 0 C-N-CA 123.271 2.647 . . . . 0.0 113.071 -179.556 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.507 ' O ' HG13 ' A' ' 16' ' ' ILE . 40.7 t -78.73 114.24 17.49 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 114.878 -1.056 . . . . 0.0 109.351 -179.972 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.548 ' HA ' HD12 ' A' ' 16' ' ' ILE . 32.7 t80 -56.7 -35.32 68.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.239 -0.891 . . . . 0.0 111.568 -171.421 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.43 -44.76 70.68 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.992 0.425 . . . . 0.0 111.049 178.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -66.56 -33.67 76.19 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.965 -0.561 . . . . 0.0 111.03 -176.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.574 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.8 mt -57.85 -40.19 74.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.909 177.779 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -72.36 -39.33 68.17 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.465 -176.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -70.14 -48.01 59.24 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.757 -0.656 . . . . 0.0 111.448 -179.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 11.7 m -78.26 -12.82 60.03 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.936 -0.575 . . . . 0.0 110.969 -178.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 26.4 mtpp 66.24 7.88 5.18 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.046 -176.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 22.9 m -138.41 134.69 34.43 Favored 'General case' 0 N--CA 1.444 -0.76 0 CA-C-N 115.74 -0.664 . . . . 0.0 109.993 -178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.679 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -80.57 165.4 22.13 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.937 -0.574 . . . . 0.0 109.688 171.169 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.444 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 25.2 m120 -139.76 151.79 46.08 Favored 'General case' 0 C--N 1.317 -0.83 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 -178.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.708 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 80.9 mt -114.01 119.69 38.05 Favored 'General case' 0 C--N 1.314 -0.94 0 C-N-CA 120.407 -0.517 . . . . 0.0 110.211 -177.139 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.7 m -105.02 123.42 47.76 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.311 0.577 . . . . 0.0 111.312 -174.259 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.44 ' HG ' ' HG ' ' A' ' 85' ' ' CYS . 42.2 t -109.83 137.06 48.16 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.063 -0.971 . . . . 0.0 110.267 179.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.574 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 1.3 tm? -127.5 122.55 33.7 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 177.039 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 24.6 t -128.14 120.95 54.74 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.45 0 CA-C-O 120.744 0.306 . . . . 0.0 110.561 -178.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.1 t -137.93 178.09 7.38 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.448 -175.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.2 m-20 59.14 42.01 19.49 Favored 'General case' 0 N--CA 1.468 0.472 0 O-C-N 123.564 0.54 . . . . 0.0 112.182 178.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.569 ' HA ' HG12 ' A' ' 4' ' ' ILE . 16.3 mt -71.9 124.06 24.04 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 108.953 -0.758 . . . . 0.0 108.953 175.554 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.423 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . -62.18 -43.43 98.85 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-O 121.026 0.441 . . . . 0.0 110.41 -178.538 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.475 HG22 ' OD2' ' A' ' 91' ' ' ASP . 3.4 t -110.5 110.43 21.16 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 169.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 9.1 p90 -85.99 110.29 19.38 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-O 121.478 0.656 . . . . 0.0 111.07 -175.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -140.48 -151.92 0.39 Allowed 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.146 -0.934 . . . . 0.0 108.98 -178.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.3 m -72.86 144.63 47.37 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 169.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.776 HD23 ' HB3' ' A' ' 66' ' ' ALA . 57.0 tp -130.18 150.39 51.46 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 121.052 0.453 . . . . 0.0 110.951 -178.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -111.07 147.2 35.33 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.644 179.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.569 ' HB ' HD13 ' A' ' 53' ' ' ILE . 30.4 mm -119.79 137.31 54.09 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 176.664 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.47 ' HB3' ' O ' ' A' ' 86' ' ' THR . 22.6 t -143.28 138.75 29.79 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 120.045 -0.662 . . . . 0.0 111.457 -177.705 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.512 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 86.3 m95 -126.22 143.23 51.22 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.605 177.014 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.39 160.4 43.46 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 178.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.487 ' HB2' ' OE1' ' A' ' 47' ' ' GLU . 18.7 m -87.59 160.13 18.3 Favored 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.634 -0.506 . . . . 0.0 109.634 176.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -54.36 -37.32 64.81 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 111.883 0.327 . . . . 0.0 111.883 -173.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.424 ' HB3' ' OE1' ' A' ' 47' ' ' GLU . 10.6 t -85.59 6.61 26.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-O 121.016 0.436 . . . . 0.0 110.995 -176.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.93 23.59 24.96 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.698 -0.763 . . . . 0.0 113.547 173.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.487 ' OE1' ' HB2' ' A' ' 43' ' ' SER . 3.2 mp0 -84.51 122.12 75.03 Favored Pre-proline 0 C--N 1.324 -0.509 0 N-CA-C 109.454 -0.572 . . . . 0.0 109.454 177.234 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.7 Cg_endo -61.6 136.73 64.69 Favored 'Trans proline' 0 N--CA 1.463 -0.285 0 C-N-CA 122.419 2.079 . . . . 0.0 111.72 177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.2 mt -113.68 139.78 48.78 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 115.956 -0.566 . . . . 0.0 111.645 -176.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -67.55 106.66 2.23 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.244 -0.889 . . . . 0.0 109.895 177.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.559 ' HA ' ' HA ' ' A' ' 70' ' ' ALA . 8.9 m -115.31 114.07 24.67 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-N 115.978 -0.556 . . . . 0.0 109.931 -176.892 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -100.86 119.81 39.22 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 119.635 -0.826 . . . . 0.0 109.574 -178.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.569 HD13 ' HB ' ' A' ' 39' ' ' ILE . 7.4 mt -135.5 137.97 48.89 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.465 0 CA-C-N 114.889 -1.05 . . . . 0.0 110.88 -169.87 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.468 ' HG3' ' O ' ' A' ' 54' ' ' LYS . 7.3 ptpp? -131.12 106.03 8.09 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.769 0.795 . . . . 0.0 110.078 164.002 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.543 HG22 HG22 ' A' ' 53' ' ' ILE . 3.4 m -146.28 95.15 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.317 -0.841 0 CA-C-N 114.928 -1.033 . . . . 0.0 110.219 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 1.5 pmm? -73.4 -22.03 60.35 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.226 179.201 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -155.92 155.03 32.14 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.798 -0.637 . . . . 0.0 109.771 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 m -78.05 135.23 37.71 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 107.457 -1.312 . . . . 0.0 107.457 170.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 70.1 m80 -95.28 126.5 45.91 Favored Pre-proline 0 C--N 1.32 -0.71 0 C-N-CA 119.941 -0.703 . . . . 0.0 111.865 -168.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -104.54 0.43 0.26 Allowed 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.71 2.94 . . . . 0.0 111.278 162.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -128.96 130.99 47.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.422 -0.808 . . . . 0.0 109.532 -177.099 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.17 -53.27 3.05 Favored Glycine 0 CA--C 1.518 0.236 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -177.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 8.2 m -122.98 164.14 19.1 Favored 'General case' 0 C--N 1.32 -0.712 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 173.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -120.84 23.87 10.5 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 117.892 0.315 . . . . 0.0 110.978 -177.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 23.3 p -161.83 174.35 13.29 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 112.762 0.653 . . . . 0.0 112.762 -169.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.776 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -106.74 145.27 32.25 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-N 114.675 -1.148 . . . . 0.0 108.184 167.981 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 26.9 mtpp -131.21 138.25 49.29 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-O 120.98 0.419 . . . . 0.0 110.072 -176.087 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.532 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -146.89 136.72 6.3 Favored Glycine 0 N--CA 1.443 -0.851 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 176.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.708 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 5.6 m -116.95 149.94 19.07 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 CA-C-N 117.319 0.559 . . . . 0.0 111.342 -179.318 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.559 ' HA ' ' HA ' ' A' ' 51' ' ' THR . . . -114.59 150.39 35.09 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 115.381 -0.827 . . . . 0.0 109.427 176.09 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 23.7 p -98.33 114.73 27.15 Favored 'General case' 0 CA--C 1.506 -0.729 0 CA-C-O 122.105 0.955 . . . . 0.0 110.063 179.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.679 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.1 t -119.41 153.36 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.628 0 CA-C-N 113.401 -1.727 . . . . 0.0 109.383 -173.513 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 16.3 m -83.98 141.1 31.46 Favored 'General case' 0 C--N 1.311 -1.093 0 N-CA-C 108.979 -0.748 . . . . 0.0 108.979 178.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.492 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.5 p -53.16 -33.13 19.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.422 0 CA-C-O 121.057 0.456 . . . . 0.0 109.901 176.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.3 mt-10 -55.62 -36.64 67.19 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.143 -0.935 . . . . 0.0 111.423 178.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 26.1 m-20 -68.15 -51.91 40.62 Favored 'General case' 0 CA--C 1.519 -0.215 0 CA-C-O 121.122 0.487 . . . . 0.0 109.974 -179.596 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.478 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -66.73 -34.96 79.0 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.695 -0.684 . . . . 0.0 110.515 -177.982 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.492 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 32.3 t30 -71.73 -22.16 61.66 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 114.836 -1.075 . . . . 0.0 110.71 -177.061 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -101.33 8.88 42.14 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.829 176.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 27.3 mmt180 64.99 37.91 6.58 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.274 177.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 14.5 mmtp -56.25 151.1 13.21 Favored 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.48 175.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -109.06 138.11 45.91 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.869 -0.605 . . . . 0.0 109.448 172.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.478 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.1 m-85 -127.6 156.05 42.89 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.827 -0.624 . . . . 0.0 110.162 179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.533 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.5 t -119.17 127.37 75.84 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.608 -176.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.512 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 49.9 t -105.47 130.94 53.44 Favored 'General case' 0 C--N 1.312 -1.061 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 174.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.547 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.6 OUTLIER -125.54 122.41 36.45 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 110.144 -0.317 . . . . 0.0 110.144 -179.552 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.0 t -108.55 127.37 65.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 120.769 0.319 . . . . 0.0 111.004 -177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.487 HG22 ' HB3' ' A' ' 95' ' ' PRO . 23.3 p -122.16 108.82 13.77 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.102 179.394 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.498 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 84.9 t60 -98.43 -50.99 4.11 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.277 -0.569 . . . . 0.0 111.977 -176.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.413 ' CB ' ' O ' ' A' ' 89' ' ' HIS . 37.6 ttt-85 128.55 -20.5 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 O-C-N 125.178 1.549 . . . . 0.0 107.735 -163.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.557 ' HB3' HD11 ' A' ' 4' ' ' ILE . 12.2 t70 -73.32 -37.32 66.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.314 -169.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -127.15 152.14 75.45 Favored Pre-proline 0 C--N 1.325 -0.495 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.281 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 65.9 Cg_endo -75.32 -23.33 13.38 Favored 'Trans proline' 0 C--N 1.344 0.34 0 C-N-CA 123.433 2.755 . . . . 0.0 112.86 -176.289 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 36.7 m -125.59 109.93 25.78 Favored Pre-proline 0 C--N 1.321 -0.666 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.481 -178.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.547 ' HB2' HG22 ' A' ' 86' ' ' THR . 14.1 Cg_endo -56.8 142.11 92.31 Favored 'Trans proline' 0 C--O 1.234 0.287 0 C-N-CA 123.026 2.484 . . . . 0.0 112.528 -178.741 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.461 ' O ' ' HA ' ' A' ' 86' ' ' THR . 41.3 mt-30 -80.94 131.37 35.33 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.102 -0.499 . . . . 0.0 111.161 -179.191 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 61.8 mtpt -109.46 127.89 54.75 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.303 179.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.533 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 57.6 mmtt -122.64 133.74 54.52 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.865 -0.607 . . . . 0.0 110.99 -178.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.417 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.0 m-85 -100.91 132.71 46.19 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 109.495 -0.558 . . . . 0.0 109.495 176.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 13.7 tt -126.63 139.02 52.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-O 121.099 0.476 . . . . 0.0 111.255 -178.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 61.1 p -158.02 149.45 21.38 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.207 -0.906 . . . . 0.0 108.613 174.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 31.9 tttm . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.215 -0.898 . . . . 0.0 109.874 178.672 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.512 ' HA ' ' HB1' ' A' ' 32' ' ' ALA . 56.7 mtt . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 121.088 0.47 . . . . 0.0 111.069 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 151.81 170.32 18.38 Favored Glycine 0 N--CA 1.447 -0.621 0 N-CA-C 110.533 -1.027 . . . . 0.0 110.533 -177.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . 0.476 ' O ' ' HB3' ' A' ' 30' ' ' ASN . 33.1 t70 -94.11 110.64 22.34 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 117.3 0.55 . . . . 0.0 110.426 179.728 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.402 HG12 ' HA ' ' A' ' 31' ' ' LEU . 66.2 mt -63.13 124.38 17.66 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.252 -0.885 . . . . 0.0 109.933 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.76 130.81 49.85 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 121.222 0.534 . . . . 0.0 109.877 -176.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.471 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.7 m -114.66 118.29 33.25 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.381 -0.827 . . . . 0.0 110.005 -175.767 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -124.69 142.68 51.22 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 121.176 0.513 . . . . 0.0 110.768 -177.131 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 1.1 p -119.29 131.61 55.78 Favored 'General case' 0 C--N 1.315 -0.902 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.122 176.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.483 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 37.1 mm -117.88 124.97 28.34 Favored Pre-proline 0 C--N 1.321 -0.66 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.302 -176.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.403 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 33.6 Cg_endo -64.35 143.64 83.47 Favored 'Trans proline' 0 C--O 1.237 0.439 0 C-N-CA 122.738 2.292 . . . . 0.0 111.798 175.86 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.571 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 44.8 Cg_endo -65.77 152.12 82.49 Favored 'Trans proline' 0 N--CA 1.462 -0.374 0 C-N-CA 122.674 2.249 . . . . 0.0 111.825 178.031 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.477 ' O ' HG13 ' A' ' 16' ' ' ILE . 34.3 t -78.23 124.29 27.91 Favored 'General case' 0 C--N 1.313 -0.997 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.645 -179.454 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -61.36 -29.55 69.97 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.409 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.37 -40.39 77.47 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.216 174.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -66.9 -45.83 76.74 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.19 178.953 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.551 HG12 ' HA ' ' A' ' 22' ' ' ALA . 73.2 mt -56.99 -33.09 41.55 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.195 0 CA-C-O 121.147 0.499 . . . . 0.0 110.693 178.458 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 63.7 t80 -66.46 -43.77 84.6 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.687 -0.688 . . . . 0.0 110.3 179.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.1 mp -76.98 -49.38 15.59 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.671 -0.695 . . . . 0.0 111.543 -179.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 10.0 m -74.14 -19.51 60.55 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.915 -174.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt 67.44 7.11 5.33 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.249 0.619 . . . . 0.0 111.198 -179.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 39.7 t -139.17 153.56 47.94 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.501 -0.772 . . . . 0.0 108.952 177.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.551 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -93.67 142.67 27.09 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 177.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.587 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 42.5 m-80 -131.19 112.42 12.81 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.12 0.486 . . . . 0.0 110.458 -173.731 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.554 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.7 mt -78.74 143.36 36.25 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 115.482 -0.781 . . . . 0.0 109.941 -177.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.483 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 28.0 m -125.59 123.0 38.08 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.336 0.588 . . . . 0.0 110.758 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.467 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 36.6 t -114.15 131.96 56.25 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-N 115.618 -0.719 . . . . 0.0 109.445 176.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.557 HD23 ' HE3' ' A' ' 67' ' ' LYS . 3.2 tm? -118.91 124.67 47.65 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 -177.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.54 ' O ' ' HB3' ' A' ' 65' ' ' SER . 14.5 t -120.18 119.74 60.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 110.113 -0.328 . . . . 0.0 110.113 178.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.5 t -134.04 177.63 7.58 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.673 -173.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.476 ' HB3' ' O ' ' A' ' 3' ' ' ASP . 1.1 t30 58.5 45.93 15.72 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 123.558 0.536 . . . . 0.0 111.447 178.397 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.646 HD13 ' HE1' ' A' ' 89' ' ' HIS . 17.7 mt -71.48 146.36 48.63 Favored 'General case' 0 C--N 1.311 -1.092 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.209 -175.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.512 ' HB1' ' HA ' ' A' ' 1' ' ' MET . . . -86.45 -48.92 7.99 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.909 -0.587 . . . . 0.0 112.502 -171.206 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 23.4 p -92.42 -102.89 0.12 Allowed 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.25 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 75.4 m-85 -109.55 -170.87 1.73 Allowed 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.478 -0.328 . . . . 0.0 110.505 -175.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.533 ' HG3' ' HG3' ' A' ' 57' ' ' GLU . 3.4 pm0 -86.48 5.34 35.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.605 0.24 . . . . 0.0 111.48 -179.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 19.4 m -64.31 103.82 0.69 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.527 -0.306 . . . . 0.0 110.814 177.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.684 HD23 ' H ' ' A' ' 38' ' ' ASN . 1.0 OUTLIER -144.3 151.34 39.23 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.164 0.507 . . . . 0.0 110.49 -177.071 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.684 ' H ' HD23 ' A' ' 37' ' ' LEU . 6.0 m120 -140.07 149.89 43.68 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.127 -0.942 . . . . 0.0 109.014 177.485 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.608 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.0 mm -120.19 136.83 55.97 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 N-CA-C 109.605 -0.517 . . . . 0.0 109.605 -177.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 14.4 t -137.3 131.59 32.47 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 120.97 0.414 . . . . 0.0 110.382 178.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.512 ' HD1' HG21 ' A' ' 51' ' ' THR . 62.3 m95 -112.8 149.91 32.39 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.698 177.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.27 163.71 39.7 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.178 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 31.9 t -88.13 171.84 9.95 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 120.598 -0.441 . . . . 0.0 109.835 175.529 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 22.9 tt0 -55.48 -29.94 59.68 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.137 0.494 . . . . 0.0 111.367 -179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.5 m -73.53 -8.62 56.66 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.922 0.392 . . . . 0.0 111.108 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 90.66 16.08 55.52 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 120.856 -0.688 . . . . 0.0 111.456 -178.8 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 12.5 pt-20 -94.31 126.97 46.27 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 110.042 -0.355 . . . . 0.0 110.042 -174.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -60.26 135.46 62.0 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 123.012 2.475 . . . . 0.0 113.565 -172.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.497 HD11 ' CD1' ' A' ' 83' ' ' PHE . 9.8 mt -97.37 147.8 23.81 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.153 -0.93 . . . . 0.0 111.02 179.719 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -70.69 106.51 3.55 Favored 'General case' 0 N--CA 1.445 -0.719 0 CA-C-O 121.886 0.851 . . . . 0.0 110.177 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.614 HG22 HD11 ' A' ' 53' ' ' ILE . 16.5 m -143.89 114.13 7.41 Favored 'General case' 0 C--N 1.31 -1.116 0 CA-C-N 113.908 -1.496 . . . . 0.0 109.382 -175.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 47.0 tttp -109.17 116.64 32.31 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 118.751 -1.179 . . . . 0.0 111.512 -178.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.614 HD11 HG22 ' A' ' 51' ' ' THR . 0.6 OUTLIER -137.2 119.23 19.16 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.886 0 N-CA-C 107.213 -1.403 . . . . 0.0 107.213 167.706 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.577 ' O ' HG13 ' A' ' 55' ' ' VAL . 49.2 tptt -110.9 103.55 12.06 Favored 'General case' 0 C--N 1.315 -0.934 0 C-N-CA 119.321 -0.952 . . . . 0.0 109.678 177.171 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.604 ' HB ' ' H ' ' A' ' 57' ' ' GLU . 0.5 OUTLIER -170.91 151.79 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 O-C-N 124.296 0.997 . . . . 0.0 110.567 -177.854 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 65.1 mtt -107.8 9.75 28.87 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 107.758 -1.201 . . . . 0.0 107.758 166.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.604 ' H ' ' HB ' ' A' ' 55' ' ' VAL . 42.7 tt0 -137.52 145.87 43.48 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 114.268 -1.333 . . . . 0.0 110.265 -167.018 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 32.6 m -78.64 154.3 30.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -94.43 127.88 42.45 Favored Pre-proline 0 CA--C 1.516 -0.342 0 C-N-CA 120.705 -0.398 . . . . 0.0 111.223 -173.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.508 ' HA ' ' O ' ' A' ' 63' ' ' THR . 93.0 Cg_endo -94.76 42.11 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 123.322 2.681 . . . . 0.0 112.772 -178.694 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -101.35 96.3 7.08 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 177.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.45 -41.28 2.48 Favored Glycine 0 CA--C 1.519 0.305 0 C-N-CA 120.919 -0.657 . . . . 0.0 111.951 -177.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.508 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 0.2 OUTLIER -123.22 165.23 17.25 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.294 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 24.5 p90 -100.78 23.16 10.93 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.781 0.801 . . . . 0.0 109.351 176.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.54 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 14.6 m -112.15 173.89 6.15 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.566 -168.402 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.493 ' HB3' HD13 ' A' ' 37' ' ' LEU . . . -106.99 143.16 35.48 Favored 'General case' 0 C--N 1.322 -0.593 0 N-CA-C 109.141 -0.688 . . . . 0.0 109.141 175.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.557 ' HE3' HD23 ' A' ' 27' ' ' LEU . 56.7 mttp -129.74 139.92 51.2 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 -179.642 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.608 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -124.88 123.97 5.22 Favored Glycine 0 N--CA 1.44 -1.075 0 N-CA-C 111.034 -0.826 . . . . 0.0 111.034 177.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.554 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 62.0 t -106.93 123.33 61.94 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.699 0 CA-C-O 120.979 0.418 . . . . 0.0 109.971 -177.663 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.587 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -113.46 136.12 53.13 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 115.834 -0.621 . . . . 0.0 110.063 -177.433 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.7 p -98.16 113.54 25.49 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.493 -177.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.509 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.0 m -119.47 164.44 15.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.155 -175.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.477 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 42.5 m -74.99 140.67 43.79 Favored 'General case' 0 C--N 1.315 -0.909 0 CA-C-N 115.821 -0.627 . . . . 0.0 109.451 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -61.54 -32.22 52.9 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 115.804 -0.635 . . . . 0.0 109.551 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.441 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 5.5 mm-40 -60.22 -33.94 72.96 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.558 -0.746 . . . . 0.0 111.229 177.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.477 ' OD2' ' HB2' ' A' ' 73' ' ' SER . 4.7 m-20 -62.16 -44.81 95.78 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.455 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -74.31 -34.85 63.6 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.435 -179.733 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.441 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 82.7 m-20 -64.29 -32.54 74.18 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.756 176.492 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -92.56 6.65 46.46 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.928 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 66.4 mtp180 58.33 38.25 25.93 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.78 -0.646 . . . . 0.0 111.834 178.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.5 mmtm -66.05 166.09 12.25 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.008 -0.542 . . . . 0.0 111.406 178.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.415 ' HG3' ' HB2' ' A' ' 101' ' ' SER . 26.6 tt0 -123.27 139.19 54.3 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.084 -178.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.497 ' CD1' HD11 ' A' ' 49' ' ' LEU . 79.2 m-85 -121.81 163.75 18.63 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 115.926 -0.579 . . . . 0.0 110.341 -179.408 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.467 HG22 ' CD1' ' A' ' 99' ' ' PHE . 89.3 t -128.42 128.08 67.84 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.474 -176.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.737 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 25.9 p -105.89 142.81 34.97 Favored 'General case' 0 C--N 1.315 -0.894 0 N-CA-C 108.998 -0.742 . . . . 0.0 108.998 174.002 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.544 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -123.53 127.31 48.15 Favored 'General case' 0 C--N 1.316 -0.858 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 177.765 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.485 HG11 HG11 ' A' ' 28' ' ' VAL . 60.3 t -106.47 127.26 61.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.079 -177.21 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -126.84 102.28 6.96 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-O 121.318 0.58 . . . . 0.0 109.493 -178.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.761 ' HD2' ' HB2' ' A' ' 91' ' ' ASP . 40.9 t60 -98.52 -9.99 24.16 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.04 -174.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.405 HH11 ' HD3' ' A' ' 90' ' ' ARG . 0.0 OUTLIER 71.07 11.43 6.95 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-O 121.831 0.824 . . . . 0.0 109.042 -174.306 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.761 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 7.0 t70 -92.66 -37.25 12.51 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 114.543 -1.208 . . . . 0.0 109.5 -176.221 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.425 HD13 ' O ' ' A' ' 94' ' ' SER . 0.5 OUTLIER -122.63 155.57 62.71 Favored Pre-proline 0 C--N 1.319 -0.721 0 CA-C-N 114.612 -1.176 . . . . 0.0 109.733 179.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 58.1 Cg_endo -72.43 -31.79 10.87 Favored 'Trans proline' 0 N--CA 1.465 -0.166 0 C-N-CA 122.811 2.341 . . . . 0.0 112.551 -177.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.425 ' O ' HD13 ' A' ' 92' ' ' LEU . 22.2 p -113.04 110.25 51.57 Favored Pre-proline 0 C--N 1.321 -0.638 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.63 -177.198 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.544 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.5 Cg_endo -62.64 141.79 87.15 Favored 'Trans proline' 0 C--O 1.234 0.32 0 C-N-CA 122.765 2.31 . . . . 0.0 111.892 178.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -83.15 136.16 34.54 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.77 0.319 . . . . 0.0 111.45 -176.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt -107.22 132.61 52.88 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.212 177.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.737 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -124.95 140.86 52.54 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.725 177.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.467 ' CD1' HG22 ' A' ' 84' ' ' VAL . 70.3 m-85 -104.83 141.08 37.14 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.837 -0.62 . . . . 0.0 110.142 -177.934 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.4 tt -140.5 137.32 36.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.805 0.336 . . . . 0.0 110.602 179.379 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.415 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 22.8 t -157.89 150.33 22.46 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 109.384 -0.598 . . . . 0.0 109.384 -178.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.455 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 1.1 tmmt? . . . . . 0 C--O 1.248 0.99 0 CA-C-O 118.366 -0.826 . . . . 0.0 110.336 -178.364 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.54 ' O ' ' HA ' ' A' ' 32' ' ' ALA . 49.1 ttm . . . . . 0 N--CA 1.48 1.039 0 N-CA-C 109.793 -0.447 . . . . 0.0 109.793 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.538 ' HA2' ' HB2' ' A' ' 32' ' ' ALA . . . -112.27 -158.92 14.36 Favored Glycine 0 N--CA 1.446 -0.637 0 C-N-CA 120.488 -0.863 . . . . 0.0 112.719 -175.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 63.17 86.24 0.12 Allowed 'General case' 0 CA--C 1.516 -0.334 0 C-N-CA 123.348 0.659 . . . . 0.0 110.939 -177.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.531 HG23 HD23 ' A' ' 31' ' ' LEU . 81.9 mt -60.32 122.29 10.29 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.792 -177.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 55.6 mt -107.63 132.2 53.57 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.145 0.497 . . . . 0.0 110.877 -179.276 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.483 HG22 HG21 ' A' ' 87' ' ' VAL . 33.4 p -107.66 127.11 53.37 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.605 -0.725 . . . . 0.0 111.268 -177.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -124.73 152.8 43.32 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.709 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 12.0 p -134.12 138.29 45.12 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.574 178.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.418 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -117.9 123.06 29.93 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.606 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.487 ' HA ' HD11 ' A' ' 100' ' ' ILE . 72.1 Cg_endo -75.32 140.15 24.27 Favored 'Trans proline' 0 C--O 1.233 0.233 0 C-N-CA 123.129 2.552 . . . . 0.0 111.819 175.245 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HG2' HD11 ' A' ' 16' ' ' ILE . 73.7 Cg_endo -70.86 150.56 61.69 Favored 'Trans proline' 0 N--CA 1.461 -0.385 0 C-N-CA 122.289 1.993 . . . . 0.0 111.754 178.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 16.4 m -78.73 144.7 34.99 Favored 'General case' 0 C--N 1.314 -0.968 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.114 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 67.3 t80 -62.39 -31.33 71.98 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.089 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -63.34 -45.03 93.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.007 -0.542 . . . . 0.0 110.312 175.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -62.68 -47.24 84.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.974 179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.407 HD11 ' HG2' ' A' ' 11' ' ' PRO . 57.6 mt -63.35 -34.14 65.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.531 0 CA-C-N 115.584 -0.735 . . . . 0.0 110.497 179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.9 t80 -73.28 -45.69 54.23 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.758 -175.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 9.9 mp -72.0 -49.37 37.59 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.669 -176.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 18.8 m -80.38 -15.83 55.91 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.158 -176.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 60.8 mttp 62.16 19.6 11.04 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.299 179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 60.7 m -141.09 154.72 46.07 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.372 172.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.764 ' HB3' HG12 ' A' ' 72' ' ' VAL . . . -104.53 162.39 13.3 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 10.4 p30 -146.84 145.91 30.03 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 109.718 -0.475 . . . . 0.0 109.718 -178.673 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.559 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 69.4 mt -107.17 128.01 54.02 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.233 -177.134 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.7 m -115.54 126.8 54.71 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.163 0.506 . . . . 0.0 111.098 -178.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.671 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 32.7 t -126.62 138.45 53.44 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.853 -0.612 . . . . 0.0 110.216 178.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.525 HD12 ' HG2' ' A' ' 67' ' ' LYS . 2.5 tt -132.34 135.82 46.43 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.235 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.45 ' O ' ' HB3' ' A' ' 65' ' ' SER . 42.1 t -118.18 125.59 74.37 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.372 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 69.4 m -127.94 176.38 7.64 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.295 -176.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.4 m-20 59.66 41.34 18.79 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.101 178.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.531 HD23 HG23 ' A' ' 4' ' ' ILE . 34.7 mt -80.49 126.85 31.73 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.549 177.39 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.54 ' HA ' ' O ' ' A' ' 1' ' ' MET . . . -66.98 -28.05 67.94 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.516 -0.311 . . . . 0.0 111.634 -178.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 66.6 p -138.38 170.21 16.43 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 116.443 -0.344 . . . . 0.0 110.458 -179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 2.2 p90 -137.16 57.37 1.75 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.205 0.526 . . . . 0.0 111.831 -177.283 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 49.2 mp0 -75.31 -59.13 2.88 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 171.031 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 9.7 t -169.14 147.57 3.84 Favored 'General case' 0 N--CA 1.448 -0.563 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.083 177.576 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.647 HD13 ' N ' ' A' ' 38' ' ' ASN . 2.2 tm? -136.98 154.14 50.5 Favored 'General case' 0 N--CA 1.442 -0.844 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 174.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.647 ' N ' HD13 ' A' ' 37' ' ' LEU . 18.8 m120 -130.83 148.54 52.61 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.027 -174.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.656 ' HB ' HD11 ' A' ' 53' ' ' ILE . 20.6 mm -119.36 134.97 61.24 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.884 0 N-CA-C 107.186 -1.413 . . . . 0.0 107.186 172.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 20.7 t -143.34 126.99 17.0 Favored 'General case' 0 C--N 1.314 -0.967 0 C-N-CA 120.613 -0.435 . . . . 0.0 110.069 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.671 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 87.7 m95 -105.15 148.35 26.97 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.2 0.524 . . . . 0.0 110.382 179.448 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.56 158.23 40.91 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 115.419 -0.81 . . . . 0.0 109.507 176.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.41 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 32.3 t -75.68 162.58 28.11 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 109.725 -0.472 . . . . 0.0 109.725 175.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.1 tp-100 -58.09 -25.16 60.97 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.258 0.551 . . . . 0.0 110.296 178.467 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 6.3 m -72.95 -8.56 56.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.737 -0.665 . . . . 0.0 111.133 179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.17 19.2 43.3 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.996 -0.621 . . . . 0.0 112.283 -179.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 13.5 mm-40 -100.03 123.57 46.65 Favored Pre-proline 0 C--N 1.324 -0.517 0 CA-C-O 120.516 0.198 . . . . 0.0 110.868 -178.191 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -60.08 141.69 96.77 Favored 'Trans proline' 0 C--O 1.234 0.3 0 C-N-CA 123.317 2.678 . . . . 0.0 113.276 -176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.42 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.9 mt -113.21 147.38 37.59 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.416 -0.811 . . . . 0.0 110.168 178.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.527 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 21.9 tt0 -56.78 107.52 0.4 Allowed 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 115.917 -0.583 . . . . 0.0 110.587 176.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 7.2 m -118.86 113.85 21.71 Favored 'General case' 0 C--N 1.316 -0.872 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.299 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 pttt -115.84 125.76 53.09 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-O 121.292 0.568 . . . . 0.0 111.175 -176.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.656 HD11 ' HB ' ' A' ' 39' ' ' ILE . 28.2 mt -133.27 138.52 51.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.268 -0.878 . . . . 0.0 110.614 -174.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.0 134.68 40.04 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 170.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.661 HG12 ' H ' ' A' ' 57' ' ' GLU . 21.7 t 68.56 112.25 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 115.587 -0.733 . . . . 0.0 111.003 -175.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.97 10.96 2.96 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-O 121.855 0.836 . . . . 0.0 110.593 179.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.661 ' H ' HG12 ' A' ' 55' ' ' VAL . 36.0 tt0 -122.1 156.1 34.3 Favored 'General case' 0 C--N 1.314 -0.949 0 N-CA-C 107.637 -1.246 . . . . 0.0 107.637 -177.24 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.5 p -74.68 142.96 44.42 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 120.955 0.407 . . . . 0.0 110.281 -171.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 17.2 m170 -92.22 129.41 41.43 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.065 -166.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.428 ' HA ' ' O ' ' A' ' 63' ' ' THR . 91.8 Cg_endo -93.86 -174.39 0.4 Allowed 'Trans proline' 0 N--CA 1.455 -0.776 0 C-N-CA 123.094 2.53 . . . . 0.0 112.878 176.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 20.2 m120 56.87 80.76 0.15 Allowed 'General case' 0 N--CA 1.468 0.434 0 O-C-N 123.882 0.739 . . . . 0.0 112.048 178.648 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 100.25 -11.57 60.14 Favored Glycine 0 N--CA 1.449 -0.467 0 N-CA-C 111.07 -0.812 . . . . 0.0 111.07 -179.041 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.725 HG22 ' H ' ' A' ' 65' ' ' SER . 3.7 m -145.7 157.15 43.98 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 178.231 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -131.81 23.36 4.63 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 107.873 -1.158 . . . . 0.0 107.873 171.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.725 ' H ' HG22 ' A' ' 63' ' ' THR . 2.0 m -136.96 173.54 11.59 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.288 -1.323 . . . . 0.0 111.975 -162.0 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -108.27 149.3 28.81 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.071 174.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.525 ' HG2' HD12 ' A' ' 27' ' ' LEU . 28.9 mtpp -131.69 139.37 49.02 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -179.595 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.505 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.36 129.2 4.61 Favored Glycine 0 N--CA 1.444 -0.787 0 C-N-CA 120.908 -0.663 . . . . 0.0 111.926 179.85 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.559 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 42.1 t -115.23 132.06 65.65 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.485 0 CA-C-O 120.788 0.328 . . . . 0.0 110.714 -177.054 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.527 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.32 151.65 35.44 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.167 177.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 4.4 m -99.33 120.74 40.06 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 121.592 0.71 . . . . 0.0 110.38 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.764 HG12 ' HB3' ' A' ' 22' ' ' ALA . 2.0 t -124.25 151.86 29.63 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.417 -1.265 . . . . 0.0 110.083 -174.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 50.7 m -88.57 153.27 21.27 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 110.152 -0.314 . . . . 0.0 110.152 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.7 t -60.87 -36.75 73.87 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-O 121.191 0.52 . . . . 0.0 109.98 -177.585 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.432 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 9.9 mm-40 -57.54 -33.88 68.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.302 -0.863 . . . . 0.0 111.778 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.6 m-20 -62.21 -48.33 80.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 121.177 0.513 . . . . 0.0 109.798 177.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.535 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -68.78 -36.24 78.06 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.756 178.096 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.432 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 87.6 m-20 -64.24 -34.35 77.9 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.02 -0.536 . . . . 0.0 110.974 178.143 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.3 m-80 -87.53 7.12 30.94 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.786 0.327 . . . . 0.0 110.666 178.423 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.453 ' HA ' ' HD3' ' A' ' 80' ' ' ARG . 23.2 mmt180 56.58 37.81 29.11 Favored 'General case' 0 N--CA 1.461 0.108 0 CA-C-N 115.394 -0.821 . . . . 0.0 110.76 178.311 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 61.8 mmtt -63.5 159.08 19.31 Favored 'General case' 0 CA--C 1.516 -0.33 0 CA-C-N 115.254 -0.884 . . . . 0.0 111.651 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -111.63 138.07 48.67 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.27 -0.877 . . . . 0.0 109.842 175.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.41 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 68.5 m-85 -122.42 154.26 37.98 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.29 177.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.511 HG22 ' CD1' ' A' ' 99' ' ' PHE . 86.2 t -123.59 128.19 74.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.723 -173.521 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.772 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 28.9 p -106.15 140.27 39.38 Favored 'General case' 0 C--N 1.314 -0.977 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 173.662 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.477 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -119.19 127.02 52.91 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.773 -179.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.483 HG21 HG22 ' A' ' 6' ' ' THR . 58.6 t -110.26 133.94 54.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.548 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.817 -178.056 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.0 p -139.06 100.67 4.09 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.176 0.512 . . . . 0.0 111.066 -175.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.521 ' O ' ' HB3' ' A' ' 90' ' ' ARG . 50.2 t60 -98.4 -8.19 27.37 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.03 -179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.521 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 52.2 ttt180 79.7 -27.6 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 O-C-N 123.782 0.676 . . . . 0.0 110.738 -176.183 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.9 t70 -71.17 -33.11 69.71 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.087 0.47 . . . . 0.0 110.75 -178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.44 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.9 OUTLIER -87.89 146.44 38.78 Favored Pre-proline 0 C--N 1.321 -0.662 0 CA-C-O 121.203 0.525 . . . . 0.0 110.752 177.489 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -78.62 -19.54 11.31 Favored 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 123.288 2.658 . . . . 0.0 112.813 -175.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD3' ' A' ' 95' ' ' PRO . 20.1 m -141.25 132.52 13.53 Favored Pre-proline 0 C--N 1.316 -0.877 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.555 179.213 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.475 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 27.3 Cg_exo -61.85 140.99 88.38 Favored 'Trans proline' 0 N--CA 1.461 -0.409 0 C-N-CA 122.497 2.131 . . . . 0.0 111.514 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -92.75 128.56 38.65 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 120.903 0.382 . . . . 0.0 110.456 179.139 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.477 ' HG2' HG23 ' A' ' 86' ' ' THR . 56.5 mtpt -106.11 141.62 37.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.368 -0.833 . . . . 0.0 109.679 178.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.772 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 30.3 mmtm -129.85 138.98 51.27 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 116.539 -0.301 . . . . 0.0 110.292 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.511 ' CD1' HG22 ' A' ' 84' ' ' VAL . 15.7 m-30 -100.98 137.56 39.2 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.149 -0.478 . . . . 0.0 109.86 179.019 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.487 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.6 tt -130.48 139.45 51.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-O 120.958 0.409 . . . . 0.0 110.722 177.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.5 p -157.38 148.7 21.84 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.611 -0.722 . . . . 0.0 109.219 176.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.463 ' HB2' ' NE1' ' A' ' 77' ' ' TRP . 27.1 tptp . . . . . 0 C--O 1.248 1.021 0 CA-C-O 118.428 -0.796 . . . . 0.0 109.687 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 56.9 mtm . . . . . 0 N--CA 1.482 1.166 0 CA-C-O 120.803 0.335 . . . . 0.0 110.545 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 149.08 179.09 24.67 Favored Glycine 0 N--CA 1.449 -0.497 0 C-N-CA 120.741 -0.743 . . . . 0.0 112.072 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -108.11 125.95 52.19 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-O 121.152 0.501 . . . . 0.0 111.664 -177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.581 HG23 HD23 ' A' ' 31' ' ' LEU . 84.0 mt -63.29 135.95 26.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.437 174.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 59.6 mt -104.54 130.79 52.46 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.929 0.395 . . . . 0.0 110.29 177.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 12.0 p -116.86 122.57 44.74 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.931 -0.577 . . . . 0.0 111.14 -179.432 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 98.1 m-85 -121.1 133.92 55.23 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.48 -179.571 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 15.5 p -112.14 134.48 53.66 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.22 176.896 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.51 ' HA ' ' HD2' ' A' ' 10' ' ' PRO . 34.0 mm -117.42 119.93 33.89 Favored Pre-proline 0 C--N 1.321 -0.644 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.574 -175.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.51 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 18.1 Cg_endo -58.31 139.59 91.12 Favored 'Trans proline' 0 C--O 1.237 0.436 0 C-N-CA 122.996 2.464 . . . . 0.0 111.802 173.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.523 ' HB2' HD11 ' A' ' 16' ' ' ILE . 43.6 Cg_endo -65.96 153.14 79.34 Favored 'Trans proline' 0 N--CA 1.464 -0.212 0 C-N-CA 123.118 2.546 . . . . 0.0 112.905 -178.558 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.499 ' O ' HG13 ' A' ' 16' ' ' ILE . 28.0 t -81.09 121.41 26.06 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 178.152 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.539 ' HA ' HD12 ' A' ' 16' ' ' ILE . 51.8 t80 -62.83 -34.08 76.59 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.105 -173.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.413 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -61.98 -46.41 89.39 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.449 177.889 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -66.25 -38.86 88.88 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.568 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.585 HG12 ' HA ' ' A' ' 22' ' ' ALA . 86.6 mt -58.9 -40.68 80.86 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.291 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.52 176.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 47.7 t80 -73.6 -43.56 59.38 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.073 -176.227 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -62.86 -48.71 77.83 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.952 -177.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.2 p -86.94 -13.95 43.22 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.176 0.512 . . . . 0.0 111.07 -178.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 91.7 mttt 59.81 27.06 16.31 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.059 -0.973 . . . . 0.0 111.049 -176.165 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 23.4 m -139.08 134.0 32.34 Favored 'General case' 0 N--CA 1.446 -0.633 0 CA-C-N 115.023 -0.99 . . . . 0.0 109.144 174.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.585 ' HA ' HG12 ' A' ' 16' ' ' ILE . . . -87.51 142.65 27.7 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 178.501 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.516 ' O ' ' HB3' ' A' ' 11' ' ' PRO . 39.2 m-80 -126.55 118.41 24.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.009 0.433 . . . . 0.0 110.091 -173.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.546 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 86.9 mt -82.82 139.15 33.68 Favored 'General case' 0 C--N 1.314 -0.962 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.959 -179.231 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.403 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 30.2 m -124.9 120.62 32.17 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 121.477 0.656 . . . . 0.0 110.937 -177.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.579 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 42.5 t -121.48 136.67 54.94 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.413 178.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.483 ' HG ' ' OG ' ' A' ' 65' ' ' SER . 2.7 tt -131.81 130.75 42.19 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 120.878 0.37 . . . . 0.0 110.303 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.531 HG11 HG21 ' A' ' 87' ' ' VAL . 12.8 t -120.76 119.5 59.72 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.467 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.687 -176.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.1 p -130.86 177.13 7.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.595 -0.275 . . . . 0.0 111.043 -173.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.2 45.28 17.62 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.298 0.57 . . . . 0.0 111.189 -179.079 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.677 HD11 HD22 ' A' ' 37' ' ' LEU . 25.4 mt -78.16 110.5 13.2 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 115.695 -0.684 . . . . 0.0 109.352 178.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.39 -50.85 62.1 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.453 -0.794 . . . . 0.0 112.407 -172.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.543 HG22 ' HB2' ' A' ' 91' ' ' ASP . 5.7 t -90.23 148.73 22.74 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 120.273 -0.571 . . . . 0.0 109.986 176.469 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 89.4 m-85 -93.91 105.15 17.18 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.53 0.681 . . . . 0.0 109.968 179.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.467 ' HG2' ' HB3' ' A' ' 90' ' ' ARG . 9.5 tp10 -151.92 174.99 12.94 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.831 -1.077 . . . . 0.0 109.248 -169.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.445 ' N ' ' HG3' ' A' ' 35' ' ' GLU . 9.3 t -60.99 146.18 47.99 Favored 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 173.115 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.677 HD22 HD11 ' A' ' 31' ' ' LEU . 48.7 tp -125.13 142.18 51.65 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-O 121.258 0.552 . . . . 0.0 110.289 177.206 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -127.21 144.45 51.04 Favored 'General case' 0 C--N 1.312 -1.048 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.202 -178.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.646 HG21 ' HA3' ' A' ' 68' ' ' GLY . 16.0 mm -119.21 134.79 61.69 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.777 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 175.446 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.411 ' HB3' ' O ' ' A' ' 86' ' ' THR . 23.2 t -141.26 129.89 22.75 Favored 'General case' 0 C--N 1.32 -0.676 0 C-N-CA 119.666 -0.814 . . . . 0.0 111.508 -178.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.579 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -105.48 146.88 28.96 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.687 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.51 164.19 38.64 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 116.102 -0.499 . . . . 0.0 109.701 179.017 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 90.8 p -75.52 170.6 15.82 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 175.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.0 tt0 -58.45 -28.51 65.36 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.139 0.495 . . . . 0.0 110.818 176.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.0 m -75.62 -8.21 56.22 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.934 -0.576 . . . . 0.0 111.219 -179.843 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.7 21.43 43.49 Favored Glycine 0 N--CA 1.446 -0.641 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.347 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.483 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 0.8 OUTLIER -96.64 122.9 55.88 Favored Pre-proline 0 N--CA 1.443 -0.775 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 179.69 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.483 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 38.1 Cg_exo -59.78 139.63 89.41 Favored 'Trans proline' 0 C--O 1.234 0.319 0 C-N-CA 123.024 2.483 . . . . 0.0 113.875 -172.307 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' A' ' 49' ' ' LEU . 7.1 mt -105.74 145.02 31.66 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.604 174.904 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -63.12 105.8 0.76 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 121.335 0.588 . . . . 0.0 110.325 -179.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.42 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.2 m -112.12 134.88 53.4 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.197 -0.91 . . . . 0.0 110.269 -176.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -109.32 122.99 48.55 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.946 0.403 . . . . 0.0 110.017 177.643 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.597 HG12 ' HB ' ' A' ' 39' ' ' ILE . 4.5 mp -128.47 133.77 66.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.674 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.78 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 54' ' ' LYS . 43.5 tptt -97.22 116.69 29.88 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 177.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.724 HG12 ' H ' ' A' ' 57' ' ' GLU . 34.7 t 78.01 116.93 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 O-C-N 124.439 1.087 . . . . 0.0 110.811 -176.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 25.9 mmt -78.4 12.78 1.8 Allowed 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.469 -0.787 . . . . 0.0 110.49 178.658 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.724 ' H ' HG12 ' A' ' 55' ' ' VAL . 33.3 mt-10 -121.3 154.72 36.0 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.308 -0.86 . . . . 0.0 108.83 -178.986 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 6.9 m -77.41 145.15 37.36 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.208 -0.451 . . . . 0.0 109.954 -176.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.429 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 33.6 m-70 -92.72 128.0 45.75 Favored Pre-proline 0 C--N 1.325 -0.466 0 C-N-CA 120.536 -0.466 . . . . 0.0 109.964 -173.868 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.449 ' HD2' ' H ' ' A' ' 61' ' ' ASN . 53.0 Cg_endo -99.0 -31.3 0.03 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.77 0 C-N-CA 123.11 2.54 . . . . 0.0 113.79 176.805 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.449 ' H ' ' HD2' ' A' ' 60' ' ' PRO . 9.9 p30 -114.41 142.07 46.83 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-O 120.729 0.3 . . . . 0.0 110.303 -178.137 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.97 -56.63 4.83 Favored Glycine 0 N--CA 1.45 -0.381 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 -177.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 16.5 m -126.56 153.51 45.13 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 172.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 13.6 p90 -111.39 23.0 14.51 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 121.385 0.612 . . . . 0.0 110.249 -179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.483 ' OG ' ' HG ' ' A' ' 27' ' ' LEU . 33.0 t -160.93 173.68 14.93 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 115.91 -0.586 . . . . 0.0 111.193 -169.52 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.431 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.66 155.74 21.1 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.482 176.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.417 ' HG2' HD12 ' A' ' 27' ' ' LEU . 46.7 mttp -129.72 139.44 51.33 Favored 'General case' 0 C--N 1.321 -0.664 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 176.032 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.646 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -121.93 118.76 3.8 Favored Glycine 0 N--CA 1.442 -0.953 0 N-CA-C 111.023 -0.831 . . . . 0.0 111.023 176.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.546 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 58.5 t -107.84 122.95 62.9 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-O 120.748 0.308 . . . . 0.0 110.451 -178.751 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.415 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.33 141.06 48.54 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.144 -0.48 . . . . 0.0 109.902 178.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.2 p -98.87 114.6 27.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 121.28 0.562 . . . . 0.0 110.326 -177.026 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.553 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.5 m -119.73 166.77 13.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 CA-C-N 115.484 -0.78 . . . . 0.0 109.774 -177.267 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.4 m -79.13 144.89 34.07 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 116.091 -0.504 . . . . 0.0 109.905 -178.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 t -57.24 -30.85 36.18 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 N-CA-C 109.044 -0.725 . . . . 0.0 109.044 173.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -60.96 -39.58 90.1 Favored 'General case' 0 C--O 1.223 -0.313 0 CA-C-N 114.851 -1.068 . . . . 0.0 111.473 177.558 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.1 m-20 -61.81 -42.35 98.91 Favored 'General case' 0 CA--C 1.519 -0.237 0 N-CA-C 109.223 -0.658 . . . . 0.0 109.223 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.558 ' CD1' ' HD2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -73.02 -39.19 66.19 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.584 179.296 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 49.0 m-20 -68.9 -23.95 64.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.639 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 52.8 m-80 -98.02 16.8 19.97 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 110.3 -0.259 . . . . 0.0 110.3 176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 102' ' ' LYS . 17.4 mmt180 55.59 36.71 27.72 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.969 173.556 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 16.2 mmtm -71.98 157.59 37.55 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.373 0.606 . . . . 0.0 111.958 -176.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.558 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 1.4 mp0 -109.23 139.11 44.59 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.055 -0.975 . . . . 0.0 110.433 179.681 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -125.37 151.81 45.62 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 115.752 -0.658 . . . . 0.0 110.219 178.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 71.9 t -122.2 122.74 67.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.834 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.399 -176.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.726 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 20.6 p -105.6 133.37 50.45 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 177.035 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.548 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -126.4 128.38 46.93 Favored 'General case' 0 C--N 1.315 -0.897 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 -178.076 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.531 HG21 HG11 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -119.84 127.41 75.88 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 CA-C-O 121.039 0.447 . . . . 0.0 112.155 -174.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 5.0 m -112.18 108.51 17.79 Favored 'General case' 0 N--CA 1.446 -0.672 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.191 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 18.5 t60 -101.21 -8.81 21.85 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.091 177.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.467 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 13.0 ttt180 74.15 -3.84 2.43 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-O 121.333 0.587 . . . . 0.0 110.317 -175.702 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.548 ' HB3' HD11 ' A' ' 4' ' ' ILE . 5.5 t70 -73.23 -36.32 66.43 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.569 -177.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.46 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -122.61 154.16 63.12 Favored Pre-proline 0 C--N 1.321 -0.633 0 CA-C-N 115.073 -0.967 . . . . 0.0 110.577 -176.563 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -68.08 -20.69 43.83 Favored 'Trans proline' 0 C--N 1.347 0.448 0 C-N-CA 123.254 2.636 . . . . 0.0 112.476 -176.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.505 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 13.7 m -129.04 111.37 18.4 Favored Pre-proline 0 C--N 1.321 -0.65 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.259 -178.725 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.548 ' HB2' HG22 ' A' ' 86' ' ' THR . 11.8 Cg_endo -55.21 148.45 49.76 Favored 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.722 2.281 . . . . 0.0 110.919 174.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.455 ' O ' ' HA ' ' A' ' 86' ' ' THR . 40.9 mt-30 -90.8 127.42 36.34 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 119.633 -0.827 . . . . 0.0 110.759 -171.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.615 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 15.9 ptmt -110.14 129.92 55.63 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.304 -178.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.726 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 67.6 mmtt -122.92 140.9 52.5 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.686 -177.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.2 m-85 -100.68 122.99 44.26 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.628 -0.715 . . . . 0.0 110.368 -178.862 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 12.9 tt -122.86 139.29 50.14 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 179.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.558 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 3.7 p -157.47 148.87 21.82 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.245 -179.094 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.558 ' HD2' ' CD1' ' A' ' 77' ' ' TRP . 49.5 tttp . . . . . 0 C--O 1.246 0.916 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.098 177.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.8 mtt . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 120.926 0.394 . . . . 0.0 110.564 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -122.23 77.31 0.34 Allowed Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 24.9 t70 -133.25 130.3 38.83 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 -176.719 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.468 HG23 HD23 ' A' ' 31' ' ' LEU . 59.6 mt -66.95 120.5 14.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 O-C-N 123.391 0.432 . . . . 0.0 110.237 -176.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.5 mt -108.77 134.41 51.52 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.17 0.509 . . . . 0.0 111.192 -175.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.513 ' HB ' ' HG3' ' A' ' 98' ' ' LYS . 0.0 OUTLIER -107.39 127.72 53.83 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.112 -177.904 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . 0.54 ' HB2' ' HB3' ' A' ' 27' ' ' LEU . 94.9 m-85 -127.34 143.15 51.27 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.988 -0.551 . . . . 0.0 109.972 177.104 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 7.1 p -119.63 137.86 53.61 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-O 120.742 0.306 . . . . 0.0 110.664 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.559 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.17 123.46 30.05 Favored Pre-proline 0 C--N 1.323 -0.566 0 CA-C-N 116.364 -0.38 . . . . 0.0 109.995 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.511 ' HA ' HD11 ' A' ' 100' ' ' ILE . 61.1 Cg_endo -70.91 148.73 58.22 Favored 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 123.124 2.549 . . . . 0.0 112.066 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -67.25 149.33 81.38 Favored 'Trans proline' 0 N--CA 1.461 -0.387 0 C-N-CA 122.585 2.19 . . . . 0.0 111.75 177.565 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.422 ' O ' HG13 ' A' ' 16' ' ' ILE . 2.8 t -103.27 143.99 31.93 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -177.035 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -58.23 -30.59 66.64 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-N 115.99 -0.55 . . . . 0.0 112.458 -172.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.435 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -67.75 -44.18 78.15 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.782 0.325 . . . . 0.0 110.314 175.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.82 -45.95 91.6 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.16 178.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.422 HG13 ' O ' ' A' ' 12' ' ' SER . 51.9 mt -61.01 -29.89 46.56 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.363 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.95 178.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 68.4 t80 -72.3 -43.92 63.48 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-O 121.109 0.48 . . . . 0.0 110.589 -179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.435 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.3 mm? -67.27 -49.53 63.96 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.262 -176.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 5.4 p -93.82 0.84 56.46 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.0 0.37 . . . . 0.0 112.0 -178.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 87.2 tttt 69.51 -48.9 0.61 Allowed 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 123.4 0.68 . . . . 0.0 111.165 -177.278 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 13.8 m -89.38 151.21 22.17 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 116.157 -0.474 . . . . 0.0 109.916 177.75 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.3 155.88 24.58 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.209 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 48.0 m-80 -129.86 126.41 37.92 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.064 0.459 . . . . 0.0 110.588 -176.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.412 HD22 HD13 ' A' ' 100' ' ' ILE . 52.7 mt -89.39 138.45 31.43 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.684 -0.689 . . . . 0.0 109.81 179.147 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.559 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 19.2 m -120.8 129.2 53.47 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.018 0.437 . . . . 0.0 110.741 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 47.0 t -109.75 137.38 47.64 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.169 -179.145 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.54 ' HB3' ' HB2' ' A' ' 7' ' ' PHE . 2.8 tm? -126.34 123.73 38.66 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 178.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 87' ' ' VAL . 15.4 t -123.89 119.63 57.47 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 110.339 -0.245 . . . . 0.0 110.339 179.821 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.9 p -133.71 177.39 7.75 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 111.611 0.226 . . . . 0.0 111.611 -173.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 59.46 40.74 20.32 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 115.717 -0.674 . . . . 0.0 111.428 177.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.65 HD11 HD22 ' A' ' 37' ' ' LEU . 58.6 mt -64.1 127.43 31.39 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.187 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.82 -27.84 69.45 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.651 -179.326 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 38.0 p -125.91 147.87 49.36 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.065 178.124 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -95.26 44.91 1.09 Allowed 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.3 0.572 . . . . 0.0 110.56 -178.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -91.27 -174.73 4.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.233 -0.894 . . . . 0.0 110.274 177.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 29.1 m -66.16 136.31 55.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.892 0.377 . . . . 0.0 110.587 176.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.65 HD22 HD11 ' A' ' 31' ' ' LEU . 49.3 tp -115.43 151.29 35.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.883 -0.414 . . . . 0.0 109.883 178.52 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -135.0 161.72 34.49 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.436 -0.579 . . . . 0.0 109.436 -179.134 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.511 HG21 ' HA3' ' A' ' 68' ' ' GLY . 27.8 mm -121.86 151.91 25.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 -177.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 37.3 m -149.98 123.74 9.23 Favored 'General case' 0 C--N 1.326 -0.435 0 O-C-N 122.084 -0.385 . . . . 0.0 111.109 176.685 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.447 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 67.4 m95 -107.76 144.87 34.29 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.174 0.512 . . . . 0.0 111.246 178.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -156.76 157.07 34.39 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.5 -0.773 . . . . 0.0 109.067 177.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.679 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 14.7 m -88.26 162.65 16.51 Favored 'General case' 0 C--N 1.313 -0.98 0 CA-C-O 121.046 0.45 . . . . 0.0 109.926 177.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -52.3 -25.05 8.52 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 114.891 -1.05 . . . . 0.0 113.821 -170.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 19.5 m -88.1 -0.78 57.48 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 120.857 0.361 . . . . 0.0 111.403 -179.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.16 22.16 28.18 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 121.324 -0.465 . . . . 0.0 112.061 178.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.679 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 8.2 pt-20 -100.4 128.76 29.51 Favored Pre-proline 0 C--N 1.326 -0.429 0 CA-C-O 120.731 0.301 . . . . 0.0 110.595 -177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 35.7 Cg_exo -61.13 141.55 94.08 Favored 'Trans proline' 0 C--N 1.345 0.347 0 C-N-CA 123.33 2.687 . . . . 0.0 113.77 -173.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.502 HD11 ' CD1' ' A' ' 83' ' ' PHE . 8.5 mt -108.19 147.71 30.94 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.512 -0.767 . . . . 0.0 110.959 177.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.419 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 4.2 mp0 -62.39 106.2 0.72 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.632 178.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 19.5 m -143.92 114.06 7.37 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 177.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -96.79 120.01 36.33 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.478 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 60.6 mt -134.99 119.27 26.65 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.547 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.075 -175.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 58.3 tttm -130.24 105.28 7.81 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 164.286 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 m -143.75 136.9 24.33 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 CA-C-O 121.449 0.642 . . . . 0.0 111.57 -175.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 52.2 ttm -109.24 -25.11 10.77 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.122 -0.945 . . . . 0.0 108.901 171.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -124.44 156.02 37.89 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.281 -175.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 11.7 p -78.51 160.76 27.49 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 171.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.542 ' HB3' ' OD1' ' A' ' 61' ' ' ASN . 73.6 m-70 -92.88 128.7 42.57 Favored Pre-proline 0 C--N 1.325 -0.478 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 -175.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.42 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 94.4 Cg_endo -94.73 25.42 0.34 Allowed 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.91 2.407 . . . . 0.0 113.363 -177.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.542 ' OD1' ' HB3' ' A' ' 59' ' ' HIS . 3.3 p-10 -97.07 107.22 19.7 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.549 0.69 . . . . 0.0 110.735 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 87.37 -42.48 3.14 Favored Glycine 0 N--CA 1.45 -0.418 0 CA-C-N 115.538 -0.755 . . . . 0.0 112.265 -178.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 1.9 m -148.57 168.57 22.41 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 -179.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 49.1 p90 -87.48 26.11 1.32 Allowed 'General case' 0 N--CA 1.468 0.443 0 CA-C-O 121.225 0.536 . . . . 0.0 111.294 179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.567 ' HB3' ' O ' ' A' ' 28' ' ' VAL . 17.3 m -110.92 173.59 6.26 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -165.303 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.62 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -106.69 146.0 31.31 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-N 116.153 -0.476 . . . . 0.0 109.861 179.824 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.556 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 55.6 mtpt -132.48 140.76 48.51 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.462 -175.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.511 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -129.33 139.37 10.91 Favored Glycine 0 N--CA 1.447 -0.596 0 N-CA-C 111.26 -0.736 . . . . 0.0 111.26 177.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.406 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 53.6 t -114.44 124.5 71.16 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.0 0.429 . . . . 0.0 110.79 -174.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.419 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -115.69 134.64 54.83 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.816 -0.629 . . . . 0.0 109.83 177.834 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 49.8 m -98.92 123.38 43.16 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.081 0.467 . . . . 0.0 110.166 -178.459 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.442 ' O ' ' HB3' ' A' ' 21' ' ' SER . 4.0 m -122.03 165.32 17.97 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.929 -175.836 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 45.1 t -86.69 150.06 24.45 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 109.486 -0.561 . . . . 0.0 109.486 178.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.9 t -63.82 -24.28 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -65.14 -36.53 84.52 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.901 -1.045 . . . . 0.0 110.731 176.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.451 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 59.7 m-20 -68.18 -44.67 75.4 Favored 'General case' 0 CA--C 1.517 -0.324 0 N-CA-C 109.151 -0.685 . . . . 0.0 109.151 179.124 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.442 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -69.18 -35.28 76.1 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 114.766 -1.106 . . . . 0.0 110.478 -179.045 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 18.1 m-20 -70.54 -27.7 64.35 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.587 178.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 37.8 m-80 -92.94 7.67 43.0 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.918 0.39 . . . . 0.0 110.326 177.423 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.9 mtt-85 58.34 37.49 25.91 Favored 'General case' 0 C--O 1.232 0.16 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.28 174.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.451 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 53.3 mtpt -67.1 156.48 36.03 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.977 178.814 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -108.51 139.23 43.55 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.273 -177.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.502 ' CD1' HD11 ' A' ' 49' ' ' LEU . 64.8 m-85 -124.71 150.62 45.98 Favored 'General case' 0 C--N 1.315 -0.901 0 CA-C-N 115.869 -0.605 . . . . 0.0 110.128 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 94.7 t -125.27 131.47 72.3 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.8 0 CA-C-N 115.596 -0.729 . . . . 0.0 110.752 -173.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 30.6 p -106.31 126.28 52.04 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 174.48 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.569 ' HB ' ' HB2' ' A' ' 95' ' ' PRO . 1.4 p -112.05 137.64 49.81 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.658 178.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.707 HG11 HG11 ' A' ' 28' ' ' VAL . 44.7 t -116.59 127.42 74.21 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.649 0 CA-C-N 116.314 -0.403 . . . . 0.0 111.603 -175.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.525 HG23 ' HB3' ' A' ' 95' ' ' PRO . 1.4 p -119.02 94.22 4.36 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.402 177.545 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.692 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 1.3 t60 -85.34 -50.78 7.05 Favored 'General case' 0 C--N 1.327 -0.402 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.33 -177.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.692 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 3.2 tmm_? 151.69 -34.4 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 O-C-N 124.758 1.286 . . . . 0.0 108.307 -176.737 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -71.37 -30.41 66.11 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.662 -1.154 . . . . 0.0 112.177 -167.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.32 148.23 43.41 Favored Pre-proline 0 C--N 1.316 -0.873 0 CA-C-O 121.105 0.479 . . . . 0.0 111.067 -178.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -78.61 -26.86 5.47 Favored 'Trans proline' 0 N--CA 1.462 -0.379 0 C-N-CA 123.271 2.647 . . . . 0.0 111.96 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 5.6 p -118.39 122.3 30.28 Favored Pre-proline 0 N--CA 1.445 -0.684 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.518 -179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.569 ' HB2' ' HB ' ' A' ' 86' ' ' THR . 18.7 Cg_endo -60.5 140.72 92.83 Favored 'Trans proline' 0 N--CA 1.46 -0.463 0 C-N-CA 122.198 1.932 . . . . 0.0 111.997 -178.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.544 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.9 pt20 -78.94 135.11 36.86 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 178.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -113.31 128.01 56.33 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-O 121.315 0.579 . . . . 0.0 111.782 -173.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.513 ' HG3' ' HB ' ' A' ' 6' ' ' THR . 6.2 tmtt? -121.98 140.91 51.89 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.331 -0.849 . . . . 0.0 109.178 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 73.5 m-85 -100.35 147.55 25.68 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 120.836 0.35 . . . . 0.0 111.101 -176.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.6 tt -133.77 138.55 50.44 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.455 176.427 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 56.9 p -158.3 149.94 21.34 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 109.122 -0.696 . . . . 0.0 109.122 178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.7 ttpm? . . . . . 0 C--O 1.252 1.188 0 CA-C-O 118.65 -0.69 . . . . 0.0 110.26 179.254 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.6 tpt . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 120.904 0.383 . . . . 0.0 110.711 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.863 ' HA3' ' HB2' ' A' ' 32' ' ' ALA . . . 174.38 56.42 0.05 OUTLIER Glycine 0 N--CA 1.446 -0.664 0 C-N-CA 120.815 -0.707 . . . . 0.0 111.612 179.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -68.62 118.47 11.67 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 120.689 0.281 . . . . 0.0 110.678 -178.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.54 HG23 HD23 ' A' ' 31' ' ' LEU . 69.3 mt -60.39 121.81 9.14 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.308 179.36 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 28' ' ' VAL . 83.4 mt -108.95 140.32 42.59 Favored 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 116.009 -0.542 . . . . 0.0 110.003 -177.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.528 ' HB ' HG21 ' A' ' 87' ' ' VAL . 2.5 t -134.21 125.41 27.76 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-O 121.202 0.525 . . . . 0.0 110.517 178.069 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -121.52 141.9 50.6 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.757 -0.656 . . . . 0.0 109.483 179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.465 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.7 p -113.55 132.44 55.71 Favored 'General case' 0 C--N 1.317 -0.817 0 CA-C-O 121.012 0.434 . . . . 0.0 111.48 -178.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.44 124.34 29.07 Favored Pre-proline 0 C--N 1.324 -0.518 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.089 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -77.91 145.0 22.08 Favored 'Trans proline' 0 N--CA 1.464 -0.228 0 C-N-CA 123.153 2.569 . . . . 0.0 112.267 178.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -72.0 147.76 49.72 Favored 'Trans proline' 0 N--CA 1.461 -0.39 0 C-N-CA 122.453 2.102 . . . . 0.0 111.539 176.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -95.91 155.17 16.86 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.648 -0.705 . . . . 0.0 111.096 -176.378 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 78.1 t80 -56.47 -43.97 80.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.555 0.217 . . . . 0.0 111.487 -173.511 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -60.65 -45.89 92.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.343 -0.39 . . . . 0.0 111.149 -179.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -64.22 -40.06 95.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.991 -0.549 . . . . 0.0 111.045 -177.603 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 66.4 mt -71.36 -30.58 40.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.704 178.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 43.6 t80 -71.85 -43.96 64.64 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.853 -174.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.2 mp -69.45 -48.15 61.75 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.734 -178.128 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 74.5 p -80.91 -13.09 59.23 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.54 -177.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.8 mttp 60.16 21.26 10.56 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.865 -177.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 9.3 m -137.82 137.75 38.48 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.951 -0.568 . . . . 0.0 110.349 -178.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.534 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -97.12 148.91 22.56 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 173.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.4 p30 -157.73 127.73 6.16 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-O 121.001 0.429 . . . . 0.0 110.484 -174.134 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.524 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.3 OUTLIER -84.41 146.94 27.39 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 179.063 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 22.7 m -124.22 120.97 33.8 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.169 0.509 . . . . 0.0 111.154 -178.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.576 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.4 t -113.27 137.69 51.12 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.144 179.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.634 HD12 ' HG2' ' A' ' 67' ' ' LYS . 1.2 tt -131.9 138.08 48.26 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.854 0.359 . . . . 0.0 110.629 175.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.622 HG22 ' H ' ' A' ' 66' ' ' ALA . 4.4 m -115.03 147.1 18.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 CA-C-N 116.211 -0.45 . . . . 0.0 110.539 178.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 64' ' ' PHE . 7.3 p -143.19 175.25 10.02 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 116.626 -0.261 . . . . 0.0 110.708 179.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 59.1 31.99 21.77 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 175.19 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.54 HD23 HG23 ' A' ' 4' ' ' ILE . 49.5 mt -71.34 118.36 14.04 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 177.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.863 ' HB2' ' HA3' ' A' ' 2' ' ' GLY . . . -75.37 -49.63 18.44 Favored 'General case' 0 C--N 1.333 -0.111 0 CA-C-O 121.163 0.506 . . . . 0.0 110.573 -179.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 14.0 p -84.52 152.36 23.97 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.982 176.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 29.0 m-85 -110.38 150.69 28.43 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 121.017 -0.273 . . . . 0.0 111.433 -172.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.423 ' O ' ' HE1' ' A' ' 89' ' ' HIS . 47.1 mt-10 66.75 164.99 0.2 Allowed 'General case' 0 N--CA 1.467 0.385 0 O-C-N 123.994 0.809 . . . . 0.0 111.863 -178.465 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 11.4 m 64.5 60.74 0.89 Allowed 'General case' 0 C--O 1.238 0.454 0 CA-C-N 115.548 -0.751 . . . . 0.0 111.463 176.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.692 HD13 ' N ' ' A' ' 38' ' ' ASN . 2.0 tm? -125.16 156.24 38.69 Favored 'General case' 0 N--CA 1.445 -0.706 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 170.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.692 ' N ' HD13 ' A' ' 37' ' ' LEU . 4.7 t-20 -149.44 155.39 40.34 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-N 115.882 -0.599 . . . . 0.0 109.627 -177.432 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.644 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.1 mm -120.87 135.23 61.72 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.758 0 N-CA-C 108.586 -0.894 . . . . 0.0 108.586 176.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 10.1 t -138.73 147.46 42.72 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 109.536 -0.542 . . . . 0.0 109.536 179.268 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.576 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 83.8 m95 -123.7 149.3 45.67 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 116.367 -0.379 . . . . 0.0 110.372 177.066 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -147.07 150.93 36.01 Favored 'General case' 0 N--CA 1.44 -0.974 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 177.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.8 m -74.73 150.6 39.38 Favored 'General case' 0 C--N 1.308 -1.238 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 173.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.58 HE22 ' HD1' ' A' ' 99' ' ' PHE . 8.8 tp-100 -52.59 -24.7 8.81 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -179.017 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.6 p -73.5 -6.72 48.23 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.934 0.397 . . . . 0.0 111.175 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.24 19.92 37.39 Favored Glycine 0 N--CA 1.448 -0.534 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.99 179.659 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.4 mt-10 -100.02 121.5 53.74 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 109.743 -0.465 . . . . 0.0 109.743 -178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 24.3 Cg_exo -63.55 139.6 71.01 Favored 'Trans proline' 0 C--O 1.233 0.249 0 C-N-CA 122.826 2.351 . . . . 0.0 112.93 -175.612 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.5 mt -107.07 145.43 32.42 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.773 -0.649 . . . . 0.0 110.596 178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -72.0 106.85 4.44 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 115.914 -0.584 . . . . 0.0 109.929 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 11.0 m -104.11 124.98 50.05 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.373 -0.831 . . . . 0.0 110.44 -176.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 59.0 tttm -122.63 136.76 54.97 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 109.203 -0.665 . . . . 0.0 109.203 176.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.63 HG12 ' HA2' ' A' ' 68' ' ' GLY . 81.1 mt -110.26 133.78 54.54 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.257 0 CA-C-N 115.987 -0.552 . . . . 0.0 110.306 -177.952 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.4 pttm -95.65 140.17 30.84 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 174.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 58.8 t 70.89 105.88 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 O-C-N 124.275 0.984 . . . . 0.0 108.443 -162.162 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -72.41 -0.92 13.78 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.587 -171.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -124.51 154.3 40.76 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 116.284 -0.416 . . . . 0.0 110.079 -176.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 38.5 m -77.96 169.04 18.95 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.367 177.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.464 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 37.8 m-70 -86.51 144.7 38.15 Favored Pre-proline 0 C--N 1.322 -0.594 0 C-N-CA 120.564 -0.454 . . . . 0.0 110.871 -170.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.514 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 11.3 Cg_exo -70.51 144.65 50.62 Favored 'Trans proline' 0 C--N 1.345 0.37 0 C-N-CA 123.62 2.88 . . . . 0.0 115.622 -163.222 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.677 ' HB3' ' HB2' ' A' ' 64' ' ' PHE . 2.7 t-20 152.02 42.64 0.0 OUTLIER 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.348 1.859 . . . . 0.0 106.351 178.147 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 76.05 -69.0 2.24 Favored Glycine 0 N--CA 1.446 -0.66 0 N-CA-C 107.161 -2.376 . . . . 0.0 107.161 -157.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.456 HG22 HD12 ' A' ' 31' ' ' LEU . 32.4 m -154.22 146.17 23.56 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.203 -1.777 . . . . 0.0 106.203 158.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.677 ' HB2' ' HB3' ' A' ' 61' ' ' ASN . 81.1 t80 -134.86 -31.91 1.0 Allowed 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.889 -0.724 . . . . 0.0 111.969 -179.224 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.528 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 32.7 t -163.16 151.32 13.72 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.963 -170.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.622 ' H ' HG22 ' A' ' 28' ' ' VAL . . . -132.73 155.93 47.96 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.448 -0.796 . . . . 0.0 109.236 170.796 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.634 ' HG2' HD12 ' A' ' 27' ' ' LEU . 29.5 mtpp -131.93 140.18 48.95 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 178.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.644 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.95 132.51 5.76 Favored Glycine 0 N--CA 1.445 -0.717 0 C-N-CA 120.411 -0.899 . . . . 0.0 112.354 -179.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.436 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 60.9 t -116.53 133.33 63.49 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 CA-C-O 120.896 0.379 . . . . 0.0 110.525 -177.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.06 139.33 49.96 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.031 -0.531 . . . . 0.0 109.611 178.428 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.3 m -97.69 119.0 35.48 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.005 0.431 . . . . 0.0 110.544 -176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.534 HG23 ' HB3' ' A' ' 22' ' ' ALA . 11.7 m -130.49 166.53 27.88 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.441 0 CA-C-N 115.374 -0.83 . . . . 0.0 109.859 -177.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.73 150.83 36.23 Favored 'General case' 0 C--N 1.321 -0.645 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.408 HG12 ' ND2' ' A' ' 78' ' ' ASN . 24.2 t -61.0 -32.98 53.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 121.73 0.776 . . . . 0.0 109.151 177.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -56.85 -38.81 73.22 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.94 178.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -66.08 -41.08 91.18 Favored 'General case' 0 CA--C 1.514 -0.416 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 -175.436 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 0.6 OUTLIER -74.65 -34.31 62.71 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.734 -0.667 . . . . 0.0 110.673 178.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.408 ' ND2' HG12 ' A' ' 74' ' ' VAL . 69.8 m-20 -69.91 -20.38 63.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.656 178.354 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -102.3 8.16 40.43 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.023 0.439 . . . . 0.0 110.772 176.706 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 49.7 mtm180 59.74 38.12 21.82 Favored 'General case' 0 C--N 1.333 -0.119 0 CA-C-N 115.369 -0.832 . . . . 0.0 111.753 176.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -63.58 164.09 10.13 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.983 0.42 . . . . 0.0 111.094 177.386 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.505 ' HG3' ' HB3' ' A' ' 101' ' ' SER . 42.1 mp0 -107.64 137.17 46.14 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.903 -0.589 . . . . 0.0 110.602 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.529 ' O ' HG22 ' A' ' 100' ' ' ILE . 60.0 m-85 -129.58 148.24 51.46 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.162 -0.926 . . . . 0.0 108.875 174.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.609 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 2.6 p -133.19 135.12 57.02 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 CA-C-O 120.842 0.353 . . . . 0.0 110.987 -174.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.4 p -104.74 142.92 33.85 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-O 121.111 0.481 . . . . 0.0 110.808 -177.308 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.521 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -113.96 130.22 56.54 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.732 176.237 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.528 HG21 ' HB ' ' A' ' 6' ' ' THR . 59.0 t -104.64 127.15 59.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.681 0 CA-C-N 115.789 -0.641 . . . . 0.0 109.783 177.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 m -127.47 94.5 4.0 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-O 121.424 0.63 . . . . 0.0 110.726 -173.396 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.457 ' C ' ' H ' ' A' ' 91' ' ' ASP . 1.4 t60 -99.54 -10.84 21.61 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.045 -178.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER 69.89 -6.76 1.02 Allowed 'General case' 0 N--CA 1.472 0.657 0 CA-C-O 121.692 0.758 . . . . 0.0 109.552 -172.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' H ' ' C ' ' A' ' 89' ' ' HIS . 19.8 t70 -72.82 -29.43 63.23 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.301 -0.863 . . . . 0.0 110.32 -177.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.405 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -118.57 154.47 52.46 Favored Pre-proline 0 C--N 1.322 -0.618 0 CA-C-N 115.122 -0.945 . . . . 0.0 110.319 178.843 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -74.64 -20.33 17.89 Favored 'Trans proline' 0 C--N 1.342 0.236 0 C-N-CA 123.118 2.545 . . . . 0.0 112.937 -177.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.446 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 52.1 p -132.13 118.57 16.32 Favored Pre-proline 0 C--N 1.322 -0.603 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 -179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.446 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 18.6 Cg_endo -58.22 141.11 96.46 Favored 'Trans proline' 0 C--N 1.345 0.376 0 C-N-CA 122.749 2.299 . . . . 0.0 111.362 177.79 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.521 ' O ' ' HA ' ' A' ' 86' ' ' THR . 45.4 mt-30 -83.9 149.71 26.18 Favored 'General case' 0 C--N 1.325 -0.494 0 C-N-CA 120.916 -0.314 . . . . 0.0 110.636 -177.094 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.496 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 28.3 mtpp -125.74 137.31 53.81 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.626 -176.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 71.3 mmtt -129.9 133.96 47.19 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 109.692 -0.485 . . . . 0.0 109.692 178.264 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.58 ' HD1' HE22 ' A' ' 44' ' ' GLN . 42.3 m-85 -101.23 124.41 46.88 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 116.386 -0.37 . . . . 0.0 110.33 -174.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.529 HG22 ' O ' ' A' ' 83' ' ' PHE . 13.0 tt -122.0 141.3 42.98 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.718 0 CA-C-O 120.896 0.379 . . . . 0.0 111.15 -178.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.505 ' HB3' ' HG3' ' A' ' 82' ' ' GLU . 22.8 p -156.86 149.53 23.53 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.469 176.64 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 1.1 tmtp? . . . . . 0 C--O 1.247 0.959 0 CA-C-O 118.921 -0.561 . . . . 0.0 109.489 179.391 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 19.2 mmt . . . . . 0 N--CA 1.481 1.09 0 CA-C-O 120.887 0.375 . . . . 0.0 111.055 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 148.64 178.15 23.48 Favored Glycine 0 N--CA 1.445 -0.735 0 CA-C-N 115.78 -0.645 . . . . 0.0 111.961 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -101.4 122.43 43.73 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.67 0.272 . . . . 0.0 110.643 178.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.499 HG23 HD23 ' A' ' 31' ' ' LEU . 28.2 mt -62.18 121.4 10.61 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.516 0 CA-C-N 115.661 -0.699 . . . . 0.0 110.591 -176.453 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.459 HD12 HD22 ' A' ' 30' ' ' ASN . 86.5 mt -115.49 132.83 56.5 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.381 -0.372 . . . . 0.0 110.831 -179.82 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 4.1 t -121.31 130.54 53.7 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.585 178.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -125.0 146.65 49.32 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.894 -0.593 . . . . 0.0 109.519 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.1 p -116.41 137.79 51.87 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.061 0.458 . . . . 0.0 111.12 -178.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.516 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -117.89 126.6 27.18 Favored Pre-proline 0 C--N 1.321 -0.634 0 CA-C-N 115.901 -0.59 . . . . 0.0 109.974 179.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.493 ' HA ' HD11 ' A' ' 100' ' ' ILE . 96.0 Cg_endo -78.7 148.36 22.69 Favored 'Trans proline' 0 C--O 1.233 0.251 0 C-N-CA 123.048 2.499 . . . . 0.0 112.55 179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 88.0 Cg_endo -77.51 150.16 27.91 Favored 'Trans proline' 0 N--CA 1.461 -0.394 0 C-N-CA 122.601 2.201 . . . . 0.0 111.506 174.46 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.472 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.7 t -88.97 149.14 23.42 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.512 -177.083 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -54.3 -43.31 71.01 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 120.765 0.317 . . . . 0.0 111.123 -174.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.446 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -60.97 -46.26 91.47 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.421 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -64.92 -37.15 86.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.428 -0.351 . . . . 0.0 111.176 -177.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 12' ' ' SER . 71.0 mt -61.46 -36.92 76.21 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 CA-C-O 121.079 0.466 . . . . 0.0 110.434 177.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 56.7 t80 -72.22 -43.82 63.85 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.919 -0.582 . . . . 0.0 110.187 -178.212 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.446 HD13 ' O ' ' A' ' 14' ' ' ALA . 10.8 mp -66.92 -48.45 68.62 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.435 -0.802 . . . . 0.0 111.235 179.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.462 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -75.51 -12.81 60.31 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.804 -0.634 . . . . 0.0 111.476 -178.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.6 mmtm 70.79 -10.65 0.71 Allowed 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.298 0.639 . . . . 0.0 111.131 -179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.462 ' H ' ' C ' ' A' ' 19' ' ' SER . 10.0 p -138.72 147.38 42.65 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 115.438 -0.801 . . . . 0.0 109.233 178.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.599 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.08 156.78 19.1 Favored 'General case' 0 C--N 1.322 -0.627 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.63 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 31.1 m-80 -139.42 116.84 11.3 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.76 -0.2 . . . . 0.0 110.639 -171.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.593 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -74.43 144.1 44.43 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 174.587 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.516 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 39.1 m -125.27 124.21 41.16 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.086 0.47 . . . . 0.0 110.415 179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.429 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 26.2 t -112.1 136.93 50.86 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 115.899 -0.592 . . . . 0.0 110.818 179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -125.08 122.68 37.88 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.413 ' O ' ' HA ' ' A' ' 65' ' ' SER . 24.3 t -121.98 126.42 74.46 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 N-CA-C 110.324 -0.25 . . . . 0.0 110.324 -179.322 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 54.7 m -139.14 176.39 8.74 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-N 116.695 -0.23 . . . . 0.0 111.383 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.459 HD22 HD12 ' A' ' 5' ' ' LEU . 97.8 m-20 57.32 50.61 11.23 Favored 'General case' 0 N--CA 1.468 0.428 0 O-C-N 123.86 0.725 . . . . 0.0 111.242 -179.421 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.499 HD23 HG23 ' A' ' 4' ' ' ILE . 65.2 mt -74.66 149.55 39.92 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.765 -0.652 . . . . 0.0 110.742 -178.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -75.61 -22.84 56.52 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.9 -177.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.454 ' H ' ' HE1' ' A' ' 89' ' ' HIS . 70.3 p -99.1 -164.38 1.12 Allowed 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 109.998 -0.371 . . . . 0.0 109.998 178.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 95.8 m-85 -102.56 -25.23 13.66 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 120.989 0.423 . . . . 0.0 110.234 178.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -163.51 -174.11 3.6 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.683 -0.69 . . . . 0.0 110.038 179.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.671 ' HA ' ' HG3' ' A' ' 57' ' ' GLU . 28.8 m 74.88 109.38 0.07 Allowed 'General case' 0 CA--C 1.532 0.261 0 O-C-N 123.581 0.55 . . . . 0.0 111.441 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.543 ' HB3' ' HB3' ' A' ' 58' ' ' SER . 54.8 tp -166.85 149.84 6.6 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.695 179.113 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -128.29 157.61 40.45 Favored 'General case' 0 C--N 1.327 -0.408 0 O-C-N 123.303 0.377 . . . . 0.0 110.302 -178.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.657 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.7 mm -122.14 137.63 55.06 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.577 -0.527 . . . . 0.0 109.577 -179.655 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 t -136.26 143.77 44.44 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 120.685 0.279 . . . . 0.0 110.369 178.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.411 ' CH2' ' HB3' ' A' ' 24' ' ' LEU . 66.7 m95 -129.15 145.82 51.22 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.981 0.419 . . . . 0.0 110.785 177.244 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.78 139.82 17.38 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.641 -0.709 . . . . 0.0 109.591 173.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.542 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 29.5 t -66.36 155.26 37.86 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-O 121.117 0.484 . . . . 0.0 110.387 174.515 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 60.1 tp60 -62.89 -24.1 67.66 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.185 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.409 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 15.4 m -76.67 -3.77 39.64 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.051 179.054 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.83 21.7 38.78 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.775 -0.726 . . . . 0.0 111.755 -179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.542 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 21.5 mt-10 -92.67 121.1 66.8 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 -178.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 17.1 Cg_exo -66.12 134.23 35.96 Favored 'Trans proline' 0 N--CA 1.458 -0.561 0 C-N-CA 121.932 1.755 . . . . 0.0 111.419 -179.194 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.896 HD12 ' HB1' ' A' ' 70' ' ' ALA . 1.7 mm? -102.68 141.48 35.42 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.302 -179.074 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -92.01 107.4 19.18 Favored 'General case' 0 C--N 1.314 -0.965 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.656 176.518 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 27.0 m -98.69 133.91 42.35 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 114.891 -1.049 . . . . 0.0 110.832 -174.563 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.489 ' HB2' HG13 ' A' ' 69' ' ' VAL . 47.8 mtmt -94.28 123.17 37.51 Favored 'General case' 0 N--CA 1.449 -0.498 0 N-CA-C 109.509 -0.552 . . . . 0.0 109.509 178.437 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.579 HD11 ' HB ' ' A' ' 39' ' ' ILE . 30.9 mm -124.94 120.78 59.46 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.213 -175.038 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.414 ' O ' ' HB ' ' A' ' 55' ' ' VAL . 91.8 mttt -97.29 110.13 22.74 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 174.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.515 HG12 ' H ' ' A' ' 57' ' ' GLU . 86.3 t 73.5 114.11 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-N 114.918 -1.037 . . . . 0.0 109.385 -168.359 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 26.8 ptt? -67.46 8.77 0.3 Allowed 'General case' 0 N--CA 1.471 0.623 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -174.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.671 ' HG3' ' HA ' ' A' ' 36' ' ' THR . 33.7 tt0 -132.81 154.81 49.94 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 -176.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.591 ' HB3' ' HB2' ' A' ' 66' ' ' ALA . 22.9 p -76.23 148.57 37.56 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 -176.553 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.439 ' HB2' ' HB ' ' A' ' 63' ' ' THR . 14.0 m-70 -92.57 124.89 57.77 Favored Pre-proline 0 C--N 1.325 -0.5 0 C-N-CA 120.21 -0.596 . . . . 0.0 109.852 -172.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -107.08 0.61 0.15 Allowed 'Trans proline' 0 N--CA 1.451 -1.004 0 C-N-CA 123.88 3.053 . . . . 0.0 113.93 177.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 15.3 m120 -97.97 -79.78 0.46 Allowed 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 120.859 -0.336 . . . . 0.0 111.224 -174.558 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -87.18 6.44 83.33 Favored Glycine 0 CA--C 1.509 -0.287 0 C-N-CA 120.811 -0.709 . . . . 0.0 111.497 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.439 ' HB ' ' HB2' ' A' ' 59' ' ' HIS . 4.9 m -149.5 166.11 30.16 Favored 'General case' 0 C--N 1.317 -0.835 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -124.12 22.63 8.65 Favored 'General case' 0 C--N 1.322 -0.599 0 N-CA-C 108.798 -0.815 . . . . 0.0 108.798 176.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 1.4 m -144.39 162.35 36.68 Favored 'General case' 0 N--CA 1.445 -0.689 0 CA-C-N 115.401 -0.818 . . . . 0.0 112.305 -167.77 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.591 ' HB2' ' HB3' ' A' ' 58' ' ' SER . . . -109.54 149.81 29.09 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.751 -1.113 . . . . 0.0 108.064 164.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.429 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 39.5 mtpt -131.94 141.24 49.26 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 110.056 -0.35 . . . . 0.0 110.056 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.657 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -137.63 131.66 5.59 Favored Glycine 0 N--CA 1.44 -1.064 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.6 -177.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.593 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -122.93 124.13 69.66 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.808 0 CA-C-O 120.989 0.423 . . . . 0.0 110.632 -177.139 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.896 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -116.36 147.38 41.66 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.859 -0.609 . . . . 0.0 110.351 -176.115 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 51.1 m -104.85 123.64 48.06 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-O 120.988 0.423 . . . . 0.0 111.309 -172.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.607 HG12 HD11 ' A' ' 49' ' ' LEU . 6.4 m -125.38 164.4 24.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.609 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.281 178.498 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.4 t -82.21 153.72 25.8 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 177.063 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.3 t -59.47 -33.75 52.45 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 CA-C-O 121.154 0.502 . . . . 0.0 110.256 -179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.421 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 7.8 mm-40 -59.93 -33.34 71.76 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.497 -0.774 . . . . 0.0 111.863 -179.191 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.464 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 15.6 m-20 -64.55 -42.43 95.71 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.436 0.636 . . . . 0.0 109.387 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.475 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.0 OUTLIER -74.03 -35.44 64.34 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.307 -0.86 . . . . 0.0 110.546 179.071 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.421 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 69.3 m-20 -64.23 -33.42 75.76 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-N 115.812 -0.631 . . . . 0.0 111.341 178.538 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.1 m-80 -90.72 8.23 35.54 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 121.112 0.482 . . . . 0.0 110.663 179.166 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 31.0 ttp180 54.5 38.28 29.42 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.345 -179.201 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.464 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 57.3 mtpt -66.36 159.81 26.03 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 116.05 -0.523 . . . . 0.0 109.751 175.763 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 16.5 tt0 -118.08 141.22 48.71 Favored 'General case' 0 C--N 1.313 -0.983 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.972 -175.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.475 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 96.6 m-85 -120.04 151.57 38.81 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.224 -177.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 96.9 t -121.42 129.41 75.61 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.913 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.583 -173.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.618 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 45.1 t -105.77 122.39 46.0 Favored 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 120.496 -0.482 . . . . 0.0 109.714 174.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -103.8 112.2 25.05 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-O 121.185 0.517 . . . . 0.0 110.701 176.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.43 ' HB ' ' CG ' ' A' ' 96' ' ' GLN . 43.2 t -97.53 125.66 50.61 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.996 0 CA-C-N 115.957 -0.565 . . . . 0.0 110.126 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.5 m -118.46 112.81 20.44 Favored 'General case' 0 N--CA 1.442 -0.847 0 CA-C-N 115.862 -0.608 . . . . 0.0 109.619 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.484 ' O ' ' HB2' ' A' ' 90' ' ' ARG . 7.3 t-160 -97.98 -50.4 4.42 Favored 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 120.707 -0.397 . . . . 0.0 110.058 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.484 ' HB2' ' O ' ' A' ' 89' ' ' HIS . 42.4 ttm180 144.89 -33.94 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.737 0 O-C-N 125.396 1.685 . . . . 0.0 109.947 177.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.479 ' OD1' HD11 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -72.04 -35.19 69.27 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.959 -168.941 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -91.64 146.05 32.39 Favored Pre-proline 0 C--N 1.318 -0.77 0 CA-C-O 121.426 0.631 . . . . 0.0 111.301 -176.141 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -72.14 -19.24 26.42 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 123.54 2.827 . . . . 0.0 112.466 -174.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 24.0 t -144.13 135.54 12.69 Favored Pre-proline 0 C--N 1.318 -0.785 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 176.933 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -57.74 141.4 95.61 Favored 'Trans proline' 0 C--O 1.234 0.279 0 C-N-CA 123.047 2.498 . . . . 0.0 112.396 -178.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.43 ' CG ' ' HB ' ' A' ' 87' ' ' VAL . 3.5 pt20 -81.42 133.25 35.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.818 -179.116 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.618 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.3 ptpt -114.82 142.71 46.18 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.304 0.574 . . . . 0.0 111.707 -175.292 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.472 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 32.7 mmtm -129.73 140.0 51.19 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.589 -0.732 . . . . 0.0 110.232 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.401 ' CD1' HG22 ' A' ' 84' ' ' VAL . 79.3 m-85 -101.36 133.45 45.94 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.035 -177.387 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.493 HD11 ' HA ' ' A' ' 10' ' ' PRO . 12.4 tt -128.68 136.3 60.21 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-O 120.996 0.426 . . . . 0.0 111.182 179.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.3 p -158.74 146.72 18.08 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.074 176.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 27.2 ttpp . . . . . 0 C--O 1.248 0.983 0 CA-C-O 118.398 -0.81 . . . . 0.0 110.633 -176.484 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.2 tmm? . . . . . 0 N--CA 1.48 1.047 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -169.81 152.58 19.76 Favored Glycine 0 N--CA 1.444 -0.772 0 N-CA-C 110.573 -1.011 . . . . 0.0 110.573 177.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.6 119.03 9.73 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 116.824 0.312 . . . . 0.0 110.225 -178.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.762 HD12 ' N ' ' A' ' 36' ' ' THR . 68.1 mt -60.37 129.08 22.47 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.429 0 N-CA-C 108.08 -1.081 . . . . 0.0 108.08 169.182 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 88.3 mt -104.1 128.82 51.76 Favored 'General case' 0 C--N 1.313 -0.985 0 C-N-CA 119.779 -0.768 . . . . 0.0 111.156 -171.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.412 HG23 ' HD3' ' A' ' 98' ' ' LYS . 4.1 t -120.3 129.31 53.95 Favored 'General case' 0 C--N 1.319 -0.744 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.717 177.1 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 27.9 t80 -131.13 141.98 50.19 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.11 -0.496 . . . . 0.0 109.738 -178.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.4 p -113.08 133.63 54.91 Favored 'General case' 0 C--N 1.315 -0.893 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.848 176.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.423 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.3 mp -116.58 124.8 29.01 Favored Pre-proline 0 C--N 1.325 -0.491 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.051 -175.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.507 ' HA ' HD11 ' A' ' 100' ' ' ILE . 52.5 Cg_endo -69.57 139.1 40.03 Favored 'Trans proline' 0 N--CA 1.462 -0.381 0 C-N-CA 122.694 2.262 . . . . 0.0 111.687 176.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.502 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 55.7 Cg_endo -65.82 144.17 76.35 Favored 'Trans proline' 0 C--O 1.234 0.295 0 C-N-CA 122.886 2.39 . . . . 0.0 111.837 179.713 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 31.1 m -85.64 148.59 25.83 Favored 'General case' 0 C--N 1.311 -1.09 0 CA-C-N 115.371 -0.832 . . . . 0.0 109.641 -179.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -54.71 -42.38 71.44 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 117.727 0.24 . . . . 0.0 111.275 -173.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.463 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -57.81 -45.1 86.6 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.325 -179.109 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -62.83 -42.19 99.63 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 120.85 0.357 . . . . 0.0 110.817 179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.452 ' HA ' ' O ' ' A' ' 21' ' ' SER . 62.1 mt -66.15 -38.82 82.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.661 178.343 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 38.7 t80 -74.03 -43.25 58.58 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.12 -172.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.463 HD13 ' O ' ' A' ' 14' ' ' ALA . 7.5 mp -64.25 -47.7 78.61 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.727 -176.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 78.6 p -85.98 -12.31 50.71 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.233 -178.101 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.405 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 32.7 mmtp 65.47 17.43 10.95 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.742 -176.486 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.452 ' O ' ' HA ' ' A' ' 16' ' ' ILE . 23.1 m -139.13 147.21 41.61 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.747 -0.66 . . . . 0.0 109.394 178.125 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -92.04 136.72 32.95 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 109.643 -0.503 . . . . 0.0 109.643 178.205 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -114.17 122.95 48.38 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 116.158 -0.473 . . . . 0.0 110.635 -173.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 83.4 mt -85.3 125.4 32.89 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.996 -0.547 . . . . 0.0 109.668 177.376 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 85.9 m -113.64 123.98 51.22 Favored 'General case' 0 C--N 1.321 -0.674 0 CA-C-O 121.314 0.578 . . . . 0.0 111.434 -176.077 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.546 ' HB3' HD12 ' A' ' 39' ' ' ILE . 18.2 t -124.38 137.05 54.5 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 115.456 -0.793 . . . . 0.0 109.656 176.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -133.51 124.22 26.6 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 -179.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.527 ' HB ' HD12 ' A' ' 37' ' ' LEU . 12.1 t -119.2 129.92 74.59 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 176.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 53.5 p -143.19 177.37 8.45 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.228 -172.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.508 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 15.2 m120 62.53 50.33 3.64 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 121.706 0.765 . . . . 0.0 109.772 174.322 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.713 HD11 ' CB ' ' A' ' 37' ' ' LEU . 0.9 OUTLIER -74.56 65.9 1.34 Allowed 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 114.597 -1.183 . . . . 0.0 110.869 -179.897 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -83.31 -2.75 56.45 Favored 'General case' 0 C--N 1.3 -1.553 0 CA-C-N 113.641 -1.618 . . . . 0.0 109.883 177.526 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.542 ' HA ' HD11 ' A' ' 4' ' ' ILE . 80.6 p 72.14 101.35 0.07 Allowed 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 113.598 -1.637 . . . . 0.0 112.125 175.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.531 ' O ' HD23 ' A' ' 92' ' ' LEU . 58.1 t80 173.36 -21.07 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 114.406 -1.27 . . . . 0.0 110.725 -179.985 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.732 ' HA ' ' CD2' ' A' ' 92' ' ' LEU . 5.6 mm-40 -144.02 38.26 1.31 Allowed 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -172.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.958 ' HB ' ' CD1' ' A' ' 92' ' ' LEU . 15.1 t 48.4 155.34 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 117.723 2.49 . . . . 0.0 117.723 169.451 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.999 ' H ' ' HB2' ' A' ' 89' ' ' HIS . 0.6 OUTLIER -150.71 149.3 29.63 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 114.708 -1.133 . . . . 0.0 111.911 175.538 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.67 ' N ' ' HB ' ' A' ' 87' ' ' VAL . 63.7 t30 163.45 175.55 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 106.103 -1.814 . . . . 0.0 106.103 166.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.613 ' HB ' HD11 ' A' ' 53' ' ' ILE . 14.7 mm -122.9 130.47 74.45 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.841 0 C-N-CA 118.77 -1.172 . . . . 0.0 109.794 169.4 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 6.8 t -155.53 121.88 5.2 Favored 'General case' 0 C--N 1.318 -0.79 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.418 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.507 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 78.0 m95 -103.04 142.27 34.39 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 121.447 0.641 . . . . 0.0 111.663 -174.052 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.05 164.97 36.11 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 114.734 -1.121 . . . . 0.0 109.116 178.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.48 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 86.9 p -82.17 168.39 17.74 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 110.12 -0.326 . . . . 0.0 110.12 177.685 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -63.7 -22.82 67.1 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.292 0.567 . . . . 0.0 110.259 174.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.6 p -87.43 -5.49 58.82 Favored 'General case' 0 N--CA 1.451 -0.392 0 CA-C-N 115.767 -0.652 . . . . 0.0 111.222 178.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.36 22.37 29.59 Favored Glycine 0 N--CA 1.45 -0.415 0 C-N-CA 121.001 -0.619 . . . . 0.0 113.793 174.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.48 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 6.5 pt-20 -93.09 133.14 29.21 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 117.449 0.624 . . . . 0.0 109.433 176.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.431 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 16.3 Cg_exo -67.8 136.52 38.98 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.689 2.259 . . . . 0.0 112.306 -177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.436 ' HA ' HD23 ' A' ' 49' ' ' LEU . 11.2 mt -109.02 140.83 42.02 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.999 -0.546 . . . . 0.0 110.785 178.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 15.3 mm-40 -59.35 107.22 0.53 Allowed 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.475 -178.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 7.8 m -131.09 126.29 35.39 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-N 114.703 -1.135 . . . . 0.0 109.745 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -103.45 123.06 46.16 Favored 'General case' 0 C--N 1.323 -0.548 0 C-N-CA 120.795 -0.362 . . . . 0.0 110.326 179.269 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.613 HD11 ' HB ' ' A' ' 39' ' ' ILE . 49.6 mm -124.5 131.31 72.92 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.446 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.619 -176.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -101.8 108.47 19.97 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.043 -0.725 . . . . 0.0 109.043 174.247 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.729 HG12 ' H ' ' A' ' 57' ' ' GLU . 47.4 t 72.35 120.55 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.361 0 O-C-N 124.213 0.946 . . . . 0.0 110.425 -173.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 83.7 mtp -79.26 10.26 3.84 Favored 'General case' 0 N--CA 1.467 0.392 0 CA-C-O 121.268 0.556 . . . . 0.0 111.269 -178.108 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.729 ' H ' HG12 ' A' ' 55' ' ' VAL . 37.6 mt-10 -121.96 156.04 34.26 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 109.003 -0.74 . . . . 0.0 109.003 178.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.459 ' HB2' ' CD1' ' A' ' 37' ' ' LEU . 34.0 t -77.11 157.16 31.18 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.329 -172.266 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 66.4 m80 -103.85 124.58 37.25 Favored Pre-proline 0 C--N 1.321 -0.643 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -108.84 13.68 0.11 Allowed 'Trans proline' 0 N--CA 1.453 -0.86 0 C-N-CA 123.69 2.927 . . . . 0.0 113.344 175.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 3.4 t-20 -93.25 -84.68 0.29 Allowed 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 121.038 -0.265 . . . . 0.0 111.124 -176.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -90.79 2.17 79.51 Favored Glycine 0 C--N 1.331 0.269 0 C-N-CA 120.821 -0.704 . . . . 0.0 111.43 177.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 4.8 m -142.99 169.3 17.82 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 107.405 -1.331 . . . . 0.0 107.405 178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 99.2 m-85 -129.77 23.4 5.38 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.036 0.445 . . . . 0.0 110.347 177.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.7 m -154.49 168.67 25.91 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.163 0.506 . . . . 0.0 112.193 -172.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -109.26 135.35 50.49 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.076 168.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 62.3 tttm -131.14 138.88 49.68 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 109.576 -0.527 . . . . 0.0 109.576 179.876 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.575 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -144.89 141.22 9.77 Favored Glycine 0 N--CA 1.444 -0.816 0 N-CA-C 111.068 -0.813 . . . . 0.0 111.068 -178.784 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 48.0 t -123.67 133.74 68.35 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 CA-C-O 120.629 0.252 . . . . 0.0 110.739 -174.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.495 ' HB3' ' HB2' ' A' ' 24' ' ' LEU . . . -116.15 142.61 46.58 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.447 178.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 6.3 p -100.0 115.46 29.75 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-O 120.956 0.408 . . . . 0.0 111.175 -178.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.554 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.9 m -119.44 166.47 13.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 CA-C-N 116.14 -0.482 . . . . 0.0 109.867 -178.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 23.1 t -81.02 151.89 28.2 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-O 121.194 0.521 . . . . 0.0 109.779 -177.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.24 -24.99 36.98 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 CA-C-N 115.687 -0.688 . . . . 0.0 109.86 179.196 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -67.71 -34.76 77.52 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.184 -0.916 . . . . 0.0 110.987 179.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 -59.41 -49.75 76.58 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-O 121.453 0.644 . . . . 0.0 109.778 178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.579 ' CE2' ' HB2' ' A' ' 102' ' ' LYS . 0.1 OUTLIER -67.78 -34.26 76.44 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.753 179.986 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -68.97 -30.37 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.26 178.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 34.7 m-80 -92.93 8.58 39.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.781 0.325 . . . . 0.0 110.602 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 56.3 mtp180 59.89 36.76 21.83 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.475 176.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 39.4 mmtm -63.41 154.67 31.32 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.929 -0.578 . . . . 0.0 111.298 179.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 100' ' ' ILE . 25.6 tt0 -118.27 139.31 51.51 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 115.56 -0.745 . . . . 0.0 109.558 177.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 87.5 m-85 -122.64 162.85 21.13 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.49 -176.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.582 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.7 t -131.35 126.35 58.42 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.588 0 CA-C-N 116.002 -0.544 . . . . 0.0 110.984 -175.684 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . . . . . . . . . 45.9 t -111.44 123.51 50.36 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.546 -0.538 . . . . 0.0 109.546 174.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.6 OUTLIER -110.68 125.62 53.65 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 -179.595 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.67 ' HB ' ' N ' ' A' ' 38' ' ' ASN . 1.6 m -107.23 145.63 14.44 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.152 0 C-N-CA 120.875 -0.33 . . . . 0.0 111.233 -175.241 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.469 ' H ' ' HB3' ' A' ' 38' ' ' ASN . 2.6 p -143.45 81.2 1.7 Allowed 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 121.521 0.676 . . . . 0.0 112.537 -164.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.999 ' HB2' ' H ' ' A' ' 37' ' ' LEU . 35.4 t60 -82.63 -9.15 59.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.54 -178.597 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 64.14 21.07 12.44 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 108.565 -0.902 . . . . 0.0 108.565 -170.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.488 ' HB2' ' HD2' ' A' ' 89' ' ' HIS . 9.2 t70 -84.46 -33.48 23.62 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.478 -1.237 . . . . 0.0 110.369 -177.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.958 ' CD1' ' HB ' ' A' ' 36' ' ' THR . 0.3 OUTLIER -136.53 163.11 52.19 Favored Pre-proline 0 C--N 1.317 -0.846 0 CA-C-N 114.812 -1.085 . . . . 0.0 110.167 -179.399 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 55.8 Cg_endo -71.23 -31.13 14.89 Favored 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.51 2.14 . . . . 0.0 112.651 179.784 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.467 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 3.9 p -109.5 102.49 49.89 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.474 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.467 ' HD2' ' HA ' ' A' ' 94' ' ' SER . 37.9 Cg_endo -64.11 152.38 81.31 Favored 'Trans proline' 0 N--CA 1.474 0.326 0 C-N-CA 123.198 2.599 . . . . 0.0 111.666 177.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.621 ' NE2' ' HB3' ' A' ' 35' ' ' GLU . 35.6 mt-30 -95.82 130.51 42.73 Favored 'General case' 0 CA--C 1.511 -0.523 0 C-N-CA 119.564 -0.854 . . . . 0.0 112.052 -175.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -105.78 132.85 51.41 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.893 177.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.582 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 3.5 mmmp? -114.52 137.51 51.76 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.544 -178.634 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 98.3 m-85 -101.28 138.85 37.76 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.722 -0.672 . . . . 0.0 109.811 179.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.507 HD11 ' HA ' ' A' ' 10' ' ' PRO . 11.4 tt -144.24 137.64 23.5 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 N-CA-C 110.049 -0.352 . . . . 0.0 110.049 178.596 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 7.7 p -157.51 149.56 22.43 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.838 0.351 . . . . 0.0 111.347 -175.691 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.579 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 21.5 tptm . . . . . 0 C--O 1.249 1.045 0 CA-C-O 118.77 -0.633 . . . . 0.0 110.028 177.526 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.8 mmt . . . . . 0 N--CA 1.484 1.244 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.23 51.61 13.11 Favored Glycine 0 N--CA 1.447 -0.567 0 N-CA-C 109.61 -1.396 . . . . 0.0 109.61 -168.438 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -74.35 124.83 27.22 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.556 -0.822 . . . . 0.0 110.836 -174.033 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.416 HG23 ' CD1' ' A' ' 31' ' ' LEU . 69.4 mt -66.97 122.26 17.67 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 115.475 -0.784 . . . . 0.0 111.681 -174.291 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 63.9 mt -105.62 135.3 47.27 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.793 -0.639 . . . . 0.0 110.395 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.509 HG23 ' HE2' ' A' ' 98' ' ' LYS . 4.3 t -125.9 130.16 50.75 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.271 0.558 . . . . 0.0 110.774 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 39.3 m-85 -126.6 136.41 52.49 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.808 -179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.7 p -113.75 132.18 55.93 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.035 0.445 . . . . 0.0 111.391 179.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -119.21 126.0 27.29 Favored Pre-proline 0 C--N 1.325 -0.493 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.203 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -73.84 145.79 36.85 Favored 'Trans proline' 0 N--CA 1.463 -0.319 0 C-N-CA 122.844 2.362 . . . . 0.0 111.815 176.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -64.21 151.54 84.96 Favored 'Trans proline' 0 N--CA 1.463 -0.301 0 C-N-CA 122.5 2.134 . . . . 0.0 111.928 178.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 36.8 p -97.33 151.6 19.75 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.817 -175.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -54.04 -43.45 70.19 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-O 120.692 0.282 . . . . 0.0 111.489 -174.457 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.456 ' O ' HD23 ' A' ' 18' ' ' LEU . . . -64.09 -46.35 84.64 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.125 -178.223 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 33.8 t70 -64.66 -41.24 96.23 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.059 -176.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 73.1 mt -62.75 -36.61 76.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.454 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.709 176.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 69.3 t80 -73.45 -45.39 54.57 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.051 0.453 . . . . 0.0 111.099 -177.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.456 HD23 ' O ' ' A' ' 14' ' ' ALA . 4.5 mm? -67.24 -48.28 68.24 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.737 -0.665 . . . . 0.0 110.95 -178.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 35.5 t -74.01 -20.25 60.38 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.13 0.49 . . . . 0.0 110.888 179.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 56.4 tttm 64.44 11.03 6.21 Favored 'General case' 0 N--CA 1.466 0.357 0 CA-C-O 121.917 0.865 . . . . 0.0 110.301 -178.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.3 m -138.78 141.56 38.79 Favored 'General case' 0 N--CA 1.446 -0.662 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.268 178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.545 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -86.92 155.4 20.23 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 176.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.605 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.3 p30 -158.17 129.15 6.42 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-O 120.867 0.365 . . . . 0.0 110.738 -173.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.481 HD22 ' H ' ' A' ' 24' ' ' LEU . 0.2 OUTLIER -87.1 142.99 27.51 Favored 'General case' 0 N--CA 1.438 -1.061 0 N-CA-C 109.676 -0.49 . . . . 0.0 109.676 177.02 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 33.9 m -122.31 116.98 25.02 Favored 'General case' 0 C--N 1.316 -0.886 0 CA-C-N 115.909 -0.587 . . . . 0.0 110.479 179.003 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.639 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.5 t -111.42 131.56 55.1 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.399 -0.819 . . . . 0.0 109.742 178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.2 tt -121.44 128.89 52.6 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.17 0.509 . . . . 0.0 109.879 178.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.82 ' HB ' HD21 ' A' ' 37' ' ' LEU . 33.3 t -121.51 132.33 70.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.965 0 CA-C-N 115.807 -0.633 . . . . 0.0 109.656 -177.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 16.2 t -142.5 175.95 9.39 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 120.895 0.379 . . . . 0.0 111.235 -172.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.453 HD22 ' N ' ' A' ' 30' ' ' ASN . 0.9 OUTLIER 63.48 46.98 4.03 Favored 'General case' 0 CA--C 1.515 -0.375 0 CA-C-N 115.082 -0.963 . . . . 0.0 110.414 175.087 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.595 HD22 ' H ' ' A' ' 31' ' ' LEU . 0.3 OUTLIER -85.94 150.73 24.3 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.657 -1.156 . . . . 0.0 109.088 179.557 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -79.25 -47.26 16.24 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.319 0.58 . . . . 0.0 109.465 176.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.0 p -101.37 92.3 4.87 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 115.32 -0.854 . . . . 0.0 109.466 173.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -46.78 -73.81 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.926 -166.306 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 24.3 mt-10 -84.23 55.41 3.33 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.221 0.534 . . . . 0.0 111.391 -174.086 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.1 m -145.26 36.99 1.12 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 122.047 0.927 . . . . 0.0 109.03 174.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.82 HD21 ' HB ' ' A' ' 28' ' ' VAL . 50.5 tp -108.44 153.16 23.71 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.137 -178.73 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -135.77 148.67 48.87 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 108.89 -0.782 . . . . 0.0 108.89 -179.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.718 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.2 mm -121.56 137.44 55.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 -179.43 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 8.6 t -146.45 144.6 29.79 Favored 'General case' 0 C--O 1.235 0.295 0 CA-C-O 120.693 0.283 . . . . 0.0 110.741 -179.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.639 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 64.5 m95 -125.19 156.75 37.96 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-O 121.139 0.495 . . . . 0.0 111.443 179.271 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.39 155.1 29.95 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.505 179.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.3 m -80.04 157.54 26.72 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 110.136 -0.32 . . . . 0.0 110.136 175.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -53.51 -25.14 15.38 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.082 -178.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 3.0 p -78.66 -2.15 37.76 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.55 -179.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.47 22.06 48.89 Favored Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.776 -178.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.452 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 42.6 mt-10 -99.55 123.82 46.69 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 -178.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.452 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 25.1 Cg_exo -61.07 136.24 63.98 Favored 'Trans proline' 0 N--CA 1.464 -0.221 0 C-N-CA 122.482 2.121 . . . . 0.0 112.097 -177.772 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.1 mt -101.8 146.29 28.0 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.137 -178.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -68.17 105.74 2.19 Favored 'General case' 0 N--CA 1.446 -0.659 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 175.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.439 HG22 HD11 ' A' ' 53' ' ' ILE . 6.3 m -118.14 114.38 22.98 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.524 -177.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -114.93 122.03 45.03 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-O 121.152 0.501 . . . . 0.0 109.977 -178.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.439 HD11 HG22 ' A' ' 51' ' ' THR . 4.7 mp -120.58 138.47 50.98 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 CA-C-N 115.362 -0.836 . . . . 0.0 109.127 -179.62 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -94.57 121.86 36.56 Favored 'General case' 0 C--N 1.318 -0.781 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 177.251 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.506 HG12 ' H ' ' A' ' 57' ' ' GLU . 22.3 t 65.37 103.06 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 O-C-N 124.279 0.987 . . . . 0.0 108.964 -162.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 40.8 tpp -74.15 12.75 0.66 Allowed 'General case' 0 N--CA 1.466 0.352 0 CA-C-O 121.849 0.833 . . . . 0.0 110.568 -178.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.506 ' H ' HG12 ' A' ' 55' ' ' VAL . 27.6 mt-10 -120.72 157.24 30.08 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.069 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 16.3 m -74.97 150.93 38.88 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 121.116 0.484 . . . . 0.0 111.24 -167.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.632 ' HB3' ' OD1' ' A' ' 61' ' ' ASN . 73.4 m-70 -104.72 134.54 19.6 Favored Pre-proline 0 C--N 1.325 -0.48 0 CA-C-N 115.567 -0.742 . . . . 0.0 112.218 -167.381 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.515 ' HA ' ' O ' ' A' ' 63' ' ' THR . 97.5 Cg_endo -98.34 15.26 0.62 Allowed 'Trans proline' 0 N--CA 1.452 -0.933 0 C-N-CA 123.525 2.817 . . . . 0.0 112.708 175.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.632 ' OD1' ' HB3' ' A' ' 59' ' ' HIS . 27.8 p-10 -89.96 80.64 6.38 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.761 0.791 . . . . 0.0 111.234 -175.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.49 1.74 87.63 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.488 -0.863 . . . . 0.0 111.728 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.515 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 7.8 t -153.28 172.89 16.31 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 179.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -125.45 23.44 7.51 Favored 'General case' 0 C--N 1.312 -1.026 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 178.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.427 ' H ' HG23 ' A' ' 63' ' ' THR . 1.4 m -126.13 172.26 10.17 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.936 -167.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -110.3 148.78 31.26 Favored 'General case' 0 CA--C 1.517 -0.322 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.561 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 18.5 ptpt -132.64 141.22 48.54 Favored 'General case' 0 C--N 1.32 -0.694 0 C-N-CA 120.872 -0.331 . . . . 0.0 110.339 179.66 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.718 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.27 128.95 6.12 Favored Glycine 0 N--CA 1.445 -0.749 0 C-N-CA 120.857 -0.687 . . . . 0.0 111.781 178.284 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.438 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.9 t -109.83 127.04 66.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-O 120.908 0.385 . . . . 0.0 110.285 -178.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.605 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.13 130.28 56.89 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.33 178.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 21.0 p -97.37 114.55 26.38 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 121.288 0.566 . . . . 0.0 111.007 -173.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.545 HG23 ' HB3' ' A' ' 22' ' ' ALA . 17.9 m -119.8 167.15 13.5 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 CA-C-N 115.171 -0.922 . . . . 0.0 110.083 -176.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 26.4 m -74.69 146.64 42.13 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.6 t -58.98 -33.26 49.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-O 121.45 0.643 . . . . 0.0 109.63 179.37 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -59.64 -33.57 71.69 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 114.912 -1.04 . . . . 0.0 111.722 179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 22.3 m-20 -63.5 -44.23 94.92 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-O 121.362 0.601 . . . . 0.0 109.653 -178.722 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.466 ' NE1' ' HD3' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -74.29 -34.13 63.43 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.522 179.501 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 73.7 m-20 -66.99 -25.16 66.18 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.054 -0.521 . . . . 0.0 111.092 176.053 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -95.35 7.38 46.36 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.703 177.912 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 35.8 ttp85 54.49 37.79 28.5 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 115.721 -0.672 . . . . 0.0 111.5 -179.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 56.3 mmtt -63.97 158.46 22.34 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.137 0.494 . . . . 0.0 111.144 178.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.467 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 35.0 tt0 -109.32 139.53 44.15 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.668 -0.697 . . . . 0.0 109.632 178.914 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -123.07 156.83 34.11 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 115.828 -0.624 . . . . 0.0 110.095 177.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.425 HG22 ' CD1' ' A' ' 99' ' ' PHE . 98.7 t -125.54 126.04 69.74 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.489 -175.145 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.838 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.3 p -105.48 142.84 34.54 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 109.422 -0.584 . . . . 0.0 109.422 176.167 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.509 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.0 OUTLIER -123.26 124.22 42.5 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.143 -0.481 . . . . 0.0 110.194 -179.928 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 46.8 t -93.73 125.55 46.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-N 116.31 -0.404 . . . . 0.0 110.433 -179.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 1.1 p -119.66 87.11 2.68 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.564 0.697 . . . . 0.0 111.061 -178.263 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.478 ' CE1' ' HB3' ' A' ' 31' ' ' LEU . 10.1 t60 -98.42 -11.55 22.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.311 -179.922 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.549 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 0.6 OUTLIER 71.14 -20.75 0.21 Allowed 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.508 0.723 . . . . 0.0 111.28 -178.669 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.463 ' H ' ' C ' ' A' ' 89' ' ' HIS . 25.0 t70 -72.35 -36.29 68.75 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.987 0.422 . . . . 0.0 110.431 178.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -83.36 150.71 61.06 Favored Pre-proline 0 C--N 1.323 -0.582 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.428 177.082 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -75.99 -20.15 15.23 Favored 'Trans proline' 0 N--CA 1.463 -0.304 0 C-N-CA 122.93 2.42 . . . . 0.0 112.508 -175.812 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 57.3 p -145.46 130.52 9.14 Favored Pre-proline 0 C--N 1.321 -0.656 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.447 178.662 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 15.4 Cg_endo -57.35 140.73 93.93 Favored 'Trans proline' 0 N--CA 1.462 -0.349 0 C-N-CA 122.512 2.141 . . . . 0.0 111.561 178.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.403 ' O ' ' HA ' ' A' ' 86' ' ' THR . 46.9 mt-30 -86.9 132.91 33.68 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.916 -177.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 51.9 mtpt -107.93 135.83 48.67 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.575 -179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.838 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 65.9 mmtt -126.54 135.74 51.68 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 115.993 -0.548 . . . . 0.0 109.885 174.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.425 ' CD1' HG22 ' A' ' 84' ' ' VAL . 61.5 m-85 -101.46 129.97 47.61 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 115.918 -0.583 . . . . 0.0 109.734 179.122 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.467 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 13.9 tt -128.51 138.99 53.12 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 C-N-CA 120.787 -0.365 . . . . 0.0 110.668 -176.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 11.5 t -154.85 149.98 26.99 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 179.442 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.466 ' HD3' ' NE1' ' A' ' 77' ' ' TRP . 22.8 tptm . . . . . 0 C--O 1.247 0.954 0 CA-C-O 118.729 -0.653 . . . . 0.0 110.931 -177.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.8 mtt . . . . . 0 N--CA 1.482 1.147 0 CA-C-O 120.598 0.237 . . . . 0.0 111.173 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -170.47 107.4 0.26 Allowed Glycine 0 N--CA 1.45 -0.424 0 C-N-CA 120.557 -0.83 . . . . 0.0 111.636 179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER 69.31 127.71 0.03 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 CA-C-O 121.605 0.717 . . . . 0.0 111.304 -175.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.481 HG23 HD23 ' A' ' 31' ' ' LEU . 77.8 mt -68.93 122.76 20.95 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.275 -0.875 . . . . 0.0 109.974 178.495 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.0 mt -104.44 130.14 52.36 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.582 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.497 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 2.4 t -127.93 130.31 48.26 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.678 -0.692 . . . . 0.0 110.197 -178.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 92.5 m-85 -128.44 146.34 50.83 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.005 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 30.4 p -112.64 135.01 53.87 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.27 178.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -116.96 122.25 31.6 Favored Pre-proline 0 C--N 1.321 -0.655 0 CA-C-N 116.097 -0.502 . . . . 0.0 110.004 -178.528 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -68.48 141.35 50.58 Favored 'Trans proline' 0 N--CA 1.462 -0.348 0 C-N-CA 122.999 2.466 . . . . 0.0 111.967 177.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.543 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.4 Cg_endo -67.87 150.19 78.35 Favored 'Trans proline' 0 N--CA 1.462 -0.354 0 C-N-CA 122.605 2.203 . . . . 0.0 111.424 177.538 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 16' ' ' ILE . 32.0 t -78.88 131.23 36.35 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.71 -177.03 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.602 ' HB2' ' HE3' ' A' ' 102' ' ' LYS . 61.6 t80 -58.83 -34.01 71.06 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.114 -174.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.17 -45.65 76.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.207 -0.451 . . . . 0.0 110.337 176.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 m-20 -65.86 -38.08 87.89 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.982 -0.553 . . . . 0.0 111.055 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.543 HD11 ' HG2' ' A' ' 11' ' ' PRO . 75.1 mt -62.08 -36.82 76.3 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.818 0.342 . . . . 0.0 110.355 176.275 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -72.38 -44.31 62.72 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.066 -0.515 . . . . 0.0 110.568 -178.002 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 10.4 mp -71.02 -48.28 53.88 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.754 -0.657 . . . . 0.0 111.586 -178.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 12.3 m -79.67 -16.18 56.21 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.871 -178.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 63.3 mttm 60.7 19.85 9.89 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.903 178.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 18.6 m -139.87 129.94 25.0 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.189 178.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.49 ' HB3' HG23 ' A' ' 72' ' ' VAL . . . -90.43 154.83 19.37 Favored 'General case' 0 C--N 1.322 -0.63 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 176.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.566 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -160.13 130.31 5.42 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-O 120.859 0.361 . . . . 0.0 110.733 -174.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.603 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.3 OUTLIER -84.22 138.29 33.04 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 177.992 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 24.4 m -120.62 127.04 51.73 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.661 -178.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.517 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 46.5 t -114.53 138.0 51.16 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.011 -178.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -122.59 123.11 40.45 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.616 ' O ' ' HA ' ' A' ' 65' ' ' SER . 46.6 t -120.96 127.05 75.89 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.078 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 12.5 t -143.69 178.8 7.55 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.75 0.309 . . . . 0.0 111.235 -175.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 60.02 33.58 21.36 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 115.491 -0.777 . . . . 0.0 112.314 177.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.681 HD11 HD22 ' A' ' 37' ' ' LEU . 56.3 mt -57.11 142.28 43.03 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.728 178.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -77.27 -50.11 13.58 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.432 178.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.51 HG22 ' OD2' ' A' ' 91' ' ' ASP . 15.1 t -107.74 168.06 9.53 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.915 -0.772 . . . . 0.0 108.915 170.265 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.8 m-85 -108.94 8.81 26.56 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.885 0.374 . . . . 0.0 110.286 -178.003 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -76.53 91.33 3.35 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.462 -173.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.0 m 59.68 102.1 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 169.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.681 HD22 HD11 ' A' ' 31' ' ' LEU . 51.0 tp -103.21 145.42 29.96 Favored 'General case' 0 C--N 1.325 -0.48 0 O-C-N 121.74 -0.6 . . . . 0.0 110.173 174.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -134.05 150.49 51.21 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.925 -178.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.687 HG21 ' HA3' ' A' ' 68' ' ' GLY . 14.1 mm -121.25 136.69 57.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 177.779 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 24.5 t -138.99 153.19 48.13 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 110.286 -0.265 . . . . 0.0 110.286 179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.517 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 73.9 m95 -134.51 146.99 50.24 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.383 0.611 . . . . 0.0 111.798 -178.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.47 165.72 34.21 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.702 -1.136 . . . . 0.0 107.969 176.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.538 ' CB ' ' HG2' ' A' ' 47' ' ' GLU . 63.1 p -88.13 173.32 8.9 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.492 -0.883 . . . . 0.0 110.955 176.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.478 ' HB2' ' HB2' ' A' ' 82' ' ' GLU . 6.0 tp-100 -58.77 -34.97 72.03 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.401 0.62 . . . . 0.0 110.062 172.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.9 m -78.55 -5.7 53.46 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.806 -178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.34 11.71 59.38 Favored Glycine 0 N--CA 1.449 -0.483 0 C-N-CA 121.11 -0.567 . . . . 0.0 113.225 174.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.538 ' HG2' ' CB ' ' A' ' 43' ' ' SER . 7.1 pt-20 -76.38 131.75 74.22 Favored Pre-proline 0 C--N 1.329 -0.315 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 -178.498 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -64.43 138.28 59.4 Favored 'Trans proline' 0 N--CA 1.461 -0.422 0 C-N-CA 122.282 1.988 . . . . 0.0 112.012 179.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.472 ' HA ' HD23 ' A' ' 49' ' ' LEU . 8.9 mt -120.16 136.07 54.75 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.73 -0.668 . . . . 0.0 111.463 -179.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -74.92 107.58 7.08 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.233 179.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 16.9 m -93.97 132.22 38.64 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.525 -177.82 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.532 ' HB2' HG13 ' A' ' 69' ' ' VAL . 43.5 mttm -97.34 122.72 40.69 Favored 'General case' 0 N--CA 1.442 -0.862 0 N-CA-C 109.65 -0.5 . . . . 0.0 109.65 176.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.45 HD11 ' HB ' ' A' ' 39' ' ' ILE . 78.9 mt -129.56 118.58 45.75 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.934 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 176.729 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 50.4 tptt -129.88 126.58 38.3 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.342 -0.844 . . . . 0.0 108.928 179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.9 m -76.56 47.3 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 CA-C-O 121.309 0.576 . . . . 0.0 111.265 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 49.0 ttm -64.41 -33.68 76.43 Favored 'General case' 0 CA--C 1.515 -0.387 0 N-CA-C 107.35 -1.352 . . . . 0.0 107.35 170.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 -151.52 132.6 14.35 Favored 'General case' 0 N--CA 1.444 -0.728 0 CA-C-N 114.269 -1.332 . . . . 0.0 110.02 169.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 18.8 p -126.05 140.89 52.23 Favored 'General case' 0 C--N 1.31 -1.128 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 169.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.75 ' HB3' ' HD2' ' A' ' 60' ' ' PRO . 28.4 m80 -89.52 161.6 39.01 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 118.472 -1.291 . . . . 0.0 111.72 -171.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.75 ' HD2' ' HB3' ' A' ' 59' ' ' HIS . 30.6 Cg_exo -13.18 138.24 0.0 OUTLIER 'Trans proline' 0 C--N 1.367 1.513 1 C-N-CA 127.988 5.792 . . . . 0.0 118.526 -166.565 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 24.7 m120 70.26 -160.8 0.15 Allowed 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 114.275 -1.329 . . . . 0.0 110.986 178.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -52.01 -54.29 26.54 Favored Glycine 0 CA--C 1.505 -0.55 0 N-CA-C 109.756 -1.338 . . . . 0.0 109.756 173.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.416 HG21 ' HB3' ' A' ' 37' ' ' LEU . 11.2 m -153.03 146.08 24.6 Favored 'General case' 0 N--CA 1.444 -0.764 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 163.053 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -133.02 -30.3 1.37 Allowed 'General case' 0 C--N 1.318 -0.78 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 170.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.707 ' HB2' ' HB2' ' A' ' 59' ' ' HIS . 11.1 m -145.01 150.83 37.58 Favored 'General case' 0 N--CA 1.442 -0.867 0 CA-C-N 114.359 -1.291 . . . . 0.0 109.674 173.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.443 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -141.49 162.43 35.51 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.76 -1.109 . . . . 0.0 109.065 -175.929 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 3.4 ptpp? -130.27 140.75 50.66 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 174.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.687 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -138.39 127.62 3.87 Favored Glycine 0 N--CA 1.44 -1.088 0 N-CA-C 110.55 -1.02 . . . . 0.0 110.55 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.603 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 0.8 OUTLIER -124.97 133.27 69.91 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.943 0 CA-C-O 121.09 0.472 . . . . 0.0 111.065 -173.512 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.566 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.73 134.51 55.04 Favored 'General case' 0 C--N 1.313 -1.022 0 CA-C-N 115.948 -0.569 . . . . 0.0 109.663 -178.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.9 m -96.77 119.11 34.64 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.126 0.489 . . . . 0.0 110.327 -174.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.49 HG23 ' HB3' ' A' ' 22' ' ' ALA . 20.0 m -126.35 166.28 22.94 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 CA-C-N 115.626 -0.716 . . . . 0.0 110.269 -175.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 34.9 t -75.02 154.65 37.93 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 109.319 -0.623 . . . . 0.0 109.319 177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 20.2 t -61.2 -33.47 56.43 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 176.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.575 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 13.2 mm-40 -62.57 -30.8 71.59 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-N 114.47 -1.241 . . . . 0.0 111.748 -178.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.68 ' O ' ' HB3' ' A' ' 81' ' ' LYS . 6.4 m-20 -59.7 -50.99 71.69 Favored 'General case' 0 CA--C 1.516 -0.34 0 CA-C-O 121.171 0.51 . . . . 0.0 109.652 177.579 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -63.11 -37.15 86.08 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.547 -0.751 . . . . 0.0 110.007 176.862 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.575 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 90.6 m-20 -69.49 -18.89 63.73 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.857 179.788 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 86.1 m-20 -94.27 7.06 46.71 Favored 'General case' 0 CA--C 1.515 -0.378 0 O-C-N 122.12 -0.363 . . . . 0.0 111.02 -178.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 62.4 mtt180 57.78 27.36 14.35 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-O 121.874 0.845 . . . . 0.0 109.525 -174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.68 ' HB3' ' O ' ' A' ' 76' ' ' ASP . 1.3 tppp? -68.5 142.64 55.23 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 114.188 -1.369 . . . . 0.0 109.963 -179.174 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 44' ' ' GLN . 58.1 mt-10 -105.99 143.93 33.43 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 120.929 0.395 . . . . 0.0 110.074 -178.431 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.496 ' HA ' ' HA ' ' A' ' 43' ' ' SER . 71.3 m-85 -121.62 154.86 36.22 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.839 176.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.659 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 67.1 t -127.68 133.76 66.92 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 115.606 -0.724 . . . . 0.0 110.18 -174.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.441 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 39.9 t -105.28 132.65 51.21 Favored 'General case' 0 C--N 1.316 -0.883 0 CA-C-N 116.432 -0.349 . . . . 0.0 110.2 178.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.49 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.0 OUTLIER -114.87 119.7 37.46 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.331 176.913 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 42.9 t -101.99 126.91 55.92 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-N 116.389 -0.368 . . . . 0.0 110.967 -178.282 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -122.27 98.48 5.95 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.645 0.736 . . . . 0.0 110.907 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 1.6 t60 -99.36 -10.51 22.19 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.572 -0.74 . . . . 0.0 111.161 -177.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.44 ' O ' ' HD2' ' A' ' 90' ' ' ARG . 1.6 tmm_? 69.91 7.12 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 CA-C-O 122.122 0.963 . . . . 0.0 108.85 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.51 ' OD2' HG22 ' A' ' 33' ' ' THR . 13.0 t70 -84.23 -33.73 24.03 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.542 -1.208 . . . . 0.0 109.287 178.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -123.73 152.56 65.95 Favored Pre-proline 0 C--N 1.32 -0.684 0 CA-C-N 114.851 -1.068 . . . . 0.0 110.073 178.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -73.85 -23.86 16.02 Favored 'Trans proline' 0 C--N 1.342 0.225 0 C-N-CA 123.061 2.508 . . . . 0.0 112.961 -175.548 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 13.5 t -131.17 124.45 20.43 Favored Pre-proline 0 C--N 1.326 -0.452 0 CA-C-O 120.902 0.382 . . . . 0.0 110.109 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.482 ' HB2' HG22 ' A' ' 86' ' ' THR . 27.8 Cg_endo -60.53 142.51 98.15 Favored 'Trans proline' 0 C--O 1.234 0.282 0 C-N-CA 123.498 2.798 . . . . 0.0 112.848 179.476 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -81.99 141.41 33.28 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 115.985 -0.552 . . . . 0.0 109.908 175.879 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.49 ' HG2' HG23 ' A' ' 86' ' ' THR . 30.6 mtpp -112.11 127.03 55.8 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 120.76 0.314 . . . . 0.0 110.549 179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.659 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 71.9 mmtt -117.64 140.05 50.18 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.51 178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.428 ' CD1' HG22 ' A' ' 84' ' ' VAL . 72.8 m-85 -101.59 131.73 47.64 Favored 'General case' 0 C--N 1.321 -0.634 0 N-CA-C 109.865 -0.421 . . . . 0.0 109.865 -178.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.3 tt -121.94 138.14 53.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 121.249 0.547 . . . . 0.0 111.336 -179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 27.1 t -159.06 150.69 20.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.096 176.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.602 ' HE3' ' HB2' ' A' ' 13' ' ' PHE . 42.7 tttm . . . . . 0 C--O 1.248 0.997 0 CA-C-O 118.7 -0.666 . . . . 0.0 109.684 176.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.9 ptp . . . . . 0 N--CA 1.479 0.991 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.9 -91.18 0.89 Allowed Glycine 0 N--CA 1.444 -0.788 0 C-N-CA 120.501 -0.857 . . . . 0.0 111.262 -175.312 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 63.52 117.35 0.02 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.282 0.633 . . . . 0.0 110.693 -178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.738 HD12 ' HB3' ' A' ' 92' ' ' LEU . 44.9 mt -59.69 121.21 6.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-O 120.993 0.425 . . . . 0.0 111.155 -172.495 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 95.2 mt -117.53 132.18 56.58 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.322 -179.229 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -108.32 127.3 53.75 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.815 179.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -115.96 130.39 56.8 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 109.159 -0.682 . . . . 0.0 109.159 174.709 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.554 ' HB ' HD12 ' A' ' 100' ' ' ILE . 11.2 p -115.9 136.46 53.02 Favored 'General case' 0 C--N 1.311 -1.101 0 CA-C-N 116.042 -0.527 . . . . 0.0 110.014 179.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.414 ' N ' HD12 ' A' ' 9' ' ' ILE . 4.1 mp -116.54 119.21 36.28 Favored Pre-proline 0 N--CA 1.442 -0.844 0 CA-C-O 121.069 0.461 . . . . 0.0 110.042 -179.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.402 ' HD2' ' HA ' ' A' ' 9' ' ' ILE . 61.1 Cg_endo -71.59 138.98 33.3 Favored 'Trans proline' 0 N--CA 1.456 -0.717 0 C-N-CA 122.554 2.169 . . . . 0.0 111.065 174.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.429 ' HD2' ' CE2' ' A' ' 77' ' ' TRP . 54.6 Cg_endo -66.97 151.8 81.46 Favored 'Trans proline' 0 N--CA 1.459 -0.504 0 C-N-CA 122.593 2.195 . . . . 0.0 111.711 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.478 ' O ' HG13 ' A' ' 16' ' ' ILE . 20.7 t -82.01 137.42 35.1 Favored 'General case' 0 C--N 1.312 -1.043 0 N-CA-C 108.359 -0.978 . . . . 0.0 108.359 177.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.523 ' HA ' HD12 ' A' ' 16' ' ' ILE . 24.4 t80 -57.88 -30.48 65.87 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.748 -0.66 . . . . 0.0 110.911 -174.812 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -69.09 -46.07 68.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.565 176.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -62.55 -39.81 94.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.497 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 13' ' ' PHE . 72.1 mt -59.48 -37.51 70.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.577 176.157 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 61.6 t80 -68.72 -42.39 77.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.361 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.6 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.2 mt -61.92 -40.15 94.47 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.811 -177.609 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.443 ' C ' ' H ' ' A' ' 21' ' ' SER . 25.9 t -88.3 -13.71 40.14 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.051 -179.206 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 19' ' ' SER . 86.0 tttt 70.88 -8.47 0.95 Allowed 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.711 0.767 . . . . 0.0 110.618 -174.102 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.443 ' H ' ' C ' ' A' ' 19' ' ' SER . 20.0 m -132.41 144.57 50.6 Favored 'General case' 0 C--N 1.315 -0.913 0 CA-C-N 115.235 -0.893 . . . . 0.0 109.268 -178.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.836 ' HB3' ' HB ' ' A' ' 72' ' ' VAL . . . -78.54 175.42 10.37 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 176.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.556 ' HA ' HG23 ' A' ' 72' ' ' VAL . 9.9 p30 -160.12 138.05 9.93 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.818 -0.438 . . . . 0.0 109.818 -177.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.702 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 31.9 mt -105.97 125.65 51.24 Favored 'General case' 0 C--N 1.315 -0.898 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.01 -176.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 28.3 m -109.0 127.32 53.98 Favored 'General case' 0 C--N 1.314 -0.954 0 CA-C-O 120.999 0.428 . . . . 0.0 110.54 -177.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.62 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 35.4 t -118.26 137.13 53.25 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.976 -178.869 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -128.15 122.68 32.51 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 175.433 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.528 ' HB ' HD21 ' A' ' 37' ' ' LEU . 39.2 t -116.08 128.37 73.4 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.752 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 43.0 p -142.26 177.31 8.34 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 120.78 0.324 . . . . 0.0 111.365 -174.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 44.7 m-80 59.79 38.36 21.53 Favored 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 115.335 -0.848 . . . . 0.0 111.723 176.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.793 HD11 HD22 ' A' ' 37' ' ' LEU . 69.8 mt -66.49 131.65 46.5 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.759 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.429 ' HB3' ' OD2' ' A' ' 91' ' ' ASP . . . -69.45 -49.85 51.11 Favored 'General case' 0 CA--C 1.522 -0.108 0 CA-C-N 116.106 -0.497 . . . . 0.0 110.579 -178.504 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.686 HG22 ' HB2' ' A' ' 91' ' ' ASP . 2.7 t -100.29 157.33 16.68 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 172.036 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.448 ' O ' ' HA3' ' A' ' 62' ' ' GLY . 56.2 m-85 -102.57 34.11 2.92 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.178 0.513 . . . . 0.0 110.922 -174.091 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.587 ' H ' HG23 ' A' ' 33' ' ' THR . 10.6 tp10 -74.91 167.96 20.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.608 175.299 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.9 m -54.1 141.35 29.03 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-O 121.205 0.526 . . . . 0.0 111.062 179.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.793 HD22 HD11 ' A' ' 31' ' ' LEU . 35.8 tp -114.03 151.97 31.66 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.2 178.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -137.0 153.63 50.62 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 -178.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.614 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -121.05 136.07 59.19 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 N-CA-C 109.506 -0.553 . . . . 0.0 109.506 -178.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 27.1 t -135.48 135.78 40.74 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.721 0.296 . . . . 0.0 110.271 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.62 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 68.8 m95 -123.24 139.0 54.5 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.099 -0.5 . . . . 0.0 111.093 178.465 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.77 160.14 42.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.741 177.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.406 ' HA ' ' HD1' ' A' ' 83' ' ' PHE . 79.0 p -87.65 161.53 17.63 Favored 'General case' 0 C--N 1.318 -0.787 0 C-N-CA 120.91 -0.316 . . . . 0.0 110.18 176.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.68 -21.42 66.54 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.038 0.447 . . . . 0.0 110.059 177.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 8.4 p -76.46 -8.46 57.21 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.811 176.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.67 22.44 31.16 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.767 -0.73 . . . . 0.0 113.036 176.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -94.47 121.96 62.17 Favored Pre-proline 0 C--N 1.322 -0.624 0 N-CA-C 109.3 -0.629 . . . . 0.0 109.3 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -62.26 135.3 53.42 Favored 'Trans proline' 0 C--O 1.236 0.381 0 C-N-CA 122.055 1.836 . . . . 0.0 110.516 175.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 49' ' ' LEU . 2.2 mt -108.31 139.79 42.5 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-O 121.367 0.604 . . . . 0.0 111.885 -171.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.498 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 3.6 tm-20 -57.22 116.51 3.32 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 114.811 -1.086 . . . . 0.0 109.386 173.75 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 24.5 m -121.75 128.08 51.36 Favored 'General case' 0 C--N 1.319 -0.74 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.681 -175.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.5 mttp -110.19 136.08 49.96 Favored 'General case' 0 N--CA 1.447 -0.599 0 N-CA-C 109.493 -0.558 . . . . 0.0 109.493 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.493 HD11 ' HB ' ' A' ' 39' ' ' ILE . 97.8 mt -129.99 118.73 45.14 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 CA-C-O 121.069 0.461 . . . . 0.0 109.978 176.756 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 28.1 ttpp -129.67 110.21 11.6 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.69 -0.686 . . . . 0.0 109.294 -179.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.0 p -91.25 87.18 2.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 CA-C-O 121.838 0.827 . . . . 0.0 111.661 -174.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 88.4 mmm -85.91 -33.6 21.16 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 168.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -142.86 130.91 21.8 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.35 -0.841 . . . . 0.0 109.615 174.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 21.3 p -134.3 166.62 22.38 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 115.616 -0.72 . . . . 0.0 109.432 178.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.729 ' HB3' ' HB3' ' A' ' 64' ' ' PHE . 14.0 m-70 -96.68 131.19 28.62 Favored Pre-proline 0 C--N 1.328 -0.338 0 C-N-CA 119.391 -0.923 . . . . 0.0 109.346 167.455 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.513 ' O ' ' HB2' ' A' ' 61' ' ' ASN . 93.1 Cg_endo -87.35 -134.01 0.01 OUTLIER 'Trans proline' 0 CA--C 1.538 0.684 0 C-N-CA 123.129 2.553 . . . . 0.0 115.602 -164.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.513 ' HB2' ' O ' ' A' ' 60' ' ' PRO . 13.2 m120 73.23 -79.01 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.919 0.888 . . . . 0.0 109.169 -164.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.448 ' HA3' ' O ' ' A' ' 34' ' ' TYR . . . -133.89 -59.27 0.07 OUTLIER Glycine 0 CA--C 1.498 -1.003 0 N-CA-C 106.984 -2.446 . . . . 0.0 106.984 166.463 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.64 HG21 ' HB3' ' A' ' 37' ' ' LEU . 5.3 m -149.28 147.42 28.35 Favored 'General case' 0 N--CA 1.442 -0.856 0 N-CA-C 107.727 -1.212 . . . . 0.0 107.727 154.448 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.729 ' HB3' ' HB3' ' A' ' 59' ' ' HIS . 63.6 t80 -133.37 -28.76 1.45 Allowed 'General case' 0 C--N 1.32 -0.707 0 CA-C-O 121.486 0.66 . . . . 0.0 109.361 175.417 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 28' ' ' VAL . 19.3 m -149.48 151.06 33.31 Favored 'General case' 0 N--CA 1.445 -0.723 0 CA-C-N 115.398 -0.819 . . . . 0.0 109.86 174.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -143.03 163.92 31.49 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.73 -172.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 23.0 mmmt -127.89 137.99 52.51 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.111 -0.699 . . . . 0.0 109.111 176.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.614 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -147.02 131.57 4.01 Favored Glycine 0 N--CA 1.442 -0.941 0 N-CA-C 110.94 -0.864 . . . . 0.0 110.94 -178.942 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.702 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.5 p -129.42 137.93 55.65 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.983 0 CA-C-O 120.68 0.276 . . . . 0.0 110.899 -177.285 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.503 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.5 151.48 33.23 Favored 'General case' 0 C--N 1.319 -0.724 0 CA-C-N 116.431 -0.349 . . . . 0.0 110.5 -177.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 26.3 m -98.0 114.16 26.21 Favored 'General case' 0 CA--C 1.506 -0.75 0 CA-C-O 122.38 1.086 . . . . 0.0 110.89 -177.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.836 ' HB ' ' HB3' ' A' ' 22' ' ' ALA . 1.7 t -116.93 167.83 9.42 Favored 'Isoleucine or valine' 0 N--CA 1.419 -2.023 0 CA-C-N 113.358 -1.746 . . . . 0.0 110.526 -172.913 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.414 ' HB2' ' OD2' ' A' ' 76' ' ' ASP . 19.0 m -100.13 139.97 35.03 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 108.717 -0.845 . . . . 0.0 108.717 175.422 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.406 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 1.9 p -54.32 -36.61 34.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 CA-C-O 121.174 0.512 . . . . 0.0 110.475 177.835 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -56.41 -36.55 69.06 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 114.756 -1.111 . . . . 0.0 111.888 -179.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.565 ' HA ' ' HD3' ' A' ' 81' ' ' LYS . 44.3 m-20 -67.26 -48.84 66.52 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.297 0.57 . . . . 0.0 109.938 -178.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.429 ' CE2' ' HD2' ' A' ' 11' ' ' PRO . 0.2 OUTLIER -69.12 -34.56 75.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.264 -179.6 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.406 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 11.5 t-20 -66.14 -22.03 66.36 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.113 -0.948 . . . . 0.0 110.241 179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.0 m-80 -102.12 10.66 39.29 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.128 177.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.422 HH11 ' HD2' ' A' ' 80' ' ' ARG . 13.4 mmt180 58.78 36.71 24.92 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.866 -0.606 . . . . 0.0 111.306 178.791 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.565 ' HD3' ' HA ' ' A' ' 76' ' ' ASP . 61.9 mtpt -74.26 164.25 26.83 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.991 0.424 . . . . 0.0 110.753 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -118.82 148.98 42.28 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.774 -0.648 . . . . 0.0 110.812 -176.076 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.406 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 93.7 m-85 -130.64 162.06 30.22 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.222 179.423 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 77.4 t -119.58 129.51 75.25 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.333 0.587 . . . . 0.0 110.953 -177.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.421 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 37.7 t -105.45 140.31 38.74 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 173.108 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.427 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 1.4 m -126.2 132.79 51.7 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 109.776 -0.453 . . . . 0.0 109.776 179.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.7 t -112.6 125.69 69.9 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.775 0 CA-C-O 121.092 0.472 . . . . 0.0 111.08 -178.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -107.6 85.76 2.18 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 115.54 -0.755 . . . . 0.0 110.616 -179.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.509 ' HB3' HD22 ' A' ' 92' ' ' LEU . 3.5 t60 -98.8 -16.84 18.75 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.76 -0.654 . . . . 0.0 111.898 -176.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 25.9 ttm180 70.89 -22.09 0.19 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.102 0.561 . . . . 0.0 111.408 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.686 ' HB2' HG22 ' A' ' 33' ' ' THR . 14.5 t0 -72.26 -37.04 69.18 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.661 0.743 . . . . 0.0 110.767 -178.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.738 ' HB3' HD12 ' A' ' 4' ' ' ILE . 1.4 pt? -89.55 147.66 38.42 Favored Pre-proline 0 C--N 1.313 -1.013 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.057 179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 8.8 Cg_endo -50.41 -32.91 35.75 Favored 'Trans proline' 0 C--O 1.234 0.296 0 C-N-CA 122.506 2.137 . . . . 0.0 112.717 -169.785 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.428 ' O ' ' HG ' ' A' ' 92' ' ' LEU . 31.5 m -155.93 154.8 28.41 Favored Pre-proline 0 C--N 1.32 -0.716 0 N-CA-C 108.77 -0.826 . . . . 0.0 108.77 176.721 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 66.1 Cg_exo -51.74 139.44 48.93 Favored 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.463 2.108 . . . . 0.0 112.062 179.409 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.427 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.8 pt20 -94.85 141.89 28.11 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.453 -177.85 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -107.73 127.59 53.82 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.138 -179.841 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -120.23 132.89 55.53 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.624 -178.175 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.36 135.72 41.36 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 110.037 -0.357 . . . . 0.0 110.037 -177.581 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.554 HD12 ' HB ' ' A' ' 8' ' ' THR . 11.9 tt -126.6 137.45 57.79 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 CA-C-O 120.948 0.404 . . . . 0.0 110.697 178.696 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 10.8 p -158.61 149.55 20.41 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.68 -0.691 . . . . 0.0 109.248 177.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 52.6 tttm . . . . . 0 C--O 1.251 1.137 0 CA-C-O 118.442 -0.789 . . . . 0.0 110.008 179.463 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 88.8 mmm . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 109.71 -0.478 . . . . 0.0 109.71 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.538 ' O ' ' HB2' ' A' ' 32' ' ' ALA . . . 90.92 16.13 55.0 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.717 -0.754 . . . . 0.0 111.295 -175.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -82.19 128.95 34.67 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 122.802 0.441 . . . . 0.0 110.701 -178.647 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.466 HG23 HD23 ' A' ' 31' ' ' LEU . 64.9 mt -60.2 123.68 13.17 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.393 0 CA-C-N 115.601 -0.727 . . . . 0.0 110.688 -179.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 65.7 mt -111.78 131.49 55.29 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.053 -177.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.2 t -117.42 130.58 56.57 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.588 -178.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 82.5 m-85 -125.9 135.4 51.87 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.335 178.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.8 p -113.36 132.78 55.47 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.836 0.35 . . . . 0.0 110.754 179.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.4 mm -117.62 124.25 29.06 Favored Pre-proline 0 C--N 1.322 -0.595 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.653 -174.792 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -67.41 139.45 49.52 Favored 'Trans proline' 0 N--CA 1.461 -0.402 0 C-N-CA 122.692 2.262 . . . . 0.0 111.583 173.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.402 ' HG2' HD11 ' A' ' 16' ' ' ILE . 48.9 Cg_endo -67.18 156.09 67.81 Favored 'Trans proline' 0 C--O 1.233 0.273 0 C-N-CA 122.993 2.462 . . . . 0.0 112.741 -178.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.459 ' O ' HG13 ' A' ' 16' ' ' ILE . 43.9 t -84.17 137.56 33.45 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.3 -0.864 . . . . 0.0 109.493 179.378 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -61.37 -42.42 98.67 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.469 -175.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.96 -35.58 81.64 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.984 0.421 . . . . 0.0 110.444 177.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -68.02 -44.25 76.95 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.983 -0.553 . . . . 0.0 110.326 179.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.459 HG13 ' O ' ' A' ' 12' ' ' SER . 81.1 mt -59.75 -36.8 68.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.879 -0.6 . . . . 0.0 110.627 176.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 44.4 t80 -72.3 -44.09 63.26 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.517 -177.001 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 7.2 mp -64.92 -48.07 75.45 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.727 -0.669 . . . . 0.0 111.504 -179.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 47.2 t -75.15 -21.41 58.81 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.789 179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 62.1 tttm 69.4 7.05 6.02 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-O 121.695 0.759 . . . . 0.0 110.309 -176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.5 t -138.49 142.1 39.39 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 177.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.501 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -88.8 144.38 26.27 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.321 -0.622 . . . . 0.0 109.321 178.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.561 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -130.39 120.36 24.15 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.495 0.664 . . . . 0.0 110.821 -174.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.687 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 60.8 mt -78.1 129.72 35.53 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.347 -0.842 . . . . 0.0 109.233 178.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 52.2 m -116.24 126.17 53.24 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-O 121.283 0.563 . . . . 0.0 111.107 -176.1 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . . . . . . . . . 37.0 t -127.17 137.0 52.84 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.149 176.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.419 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -131.13 137.05 48.86 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 120.995 0.426 . . . . 0.0 110.642 177.045 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.962 HG21 HD21 ' A' ' 37' ' ' LEU . 11.8 m -117.65 145.3 23.71 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.627 0 CA-C-N 116.009 -0.541 . . . . 0.0 110.767 179.875 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.1 t -142.36 176.43 9.0 Favored 'General case' 0 C--N 1.315 -0.935 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.6 m-20 58.32 48.77 11.99 Favored 'General case' 0 N--CA 1.468 0.438 0 O-C-N 123.544 0.527 . . . . 0.0 112.068 178.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.466 HD23 HG23 ' A' ' 4' ' ' ILE . 26.2 mt -82.11 117.03 21.96 Favored 'General case' 0 C--N 1.321 -0.659 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 177.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.538 ' HB2' ' O ' ' A' ' 2' ' ' GLY . . . -59.19 -43.38 92.21 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-O 121.399 0.619 . . . . 0.0 110.685 178.145 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 4.8 t -105.16 145.13 31.0 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.242 172.612 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 73.2 m-85 -113.09 45.57 1.35 Allowed 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.285 0.564 . . . . 0.0 110.97 179.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 59.9 mt-10 -92.09 -160.31 0.73 Allowed 'General case' 0 C--N 1.325 -0.476 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.266 173.251 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 25.0 m -52.06 126.23 17.89 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.591 177.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.962 HD21 HG21 ' A' ' 28' ' ' VAL . 34.0 tp -126.27 149.44 49.1 Favored 'General case' 0 N--CA 1.444 -0.738 0 CA-C-N 116.008 -0.542 . . . . 0.0 109.61 174.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.424 ' H ' HD12 ' A' ' 37' ' ' LEU . 0.6 OUTLIER -135.03 150.38 50.29 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 116.142 -0.481 . . . . 0.0 109.976 -177.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.572 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.8 mm -120.5 136.32 57.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 N-CA-C 107.837 -1.172 . . . . 0.0 107.837 176.29 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.4 m -128.36 126.59 41.0 Favored 'General case' 0 C--N 1.318 -0.778 0 C-N-CA 120.388 -0.525 . . . . 0.0 111.29 -178.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.42 ' HB2' ' OG1' ' A' ' 51' ' ' THR . 67.8 m95 -108.29 137.84 45.58 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.794 175.338 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -151.03 165.15 34.64 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.245 -0.889 . . . . 0.0 109.175 179.029 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.717 ' HB3' ' HG2' ' A' ' 47' ' ' GLU . 24.1 t -79.61 173.27 12.76 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 173.765 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.597 ' HA ' HG23 ' A' ' 84' ' ' VAL . 52.7 tt0 -53.3 -33.67 54.22 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 112.267 0.469 . . . . 0.0 112.267 -172.15 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.4 t -77.52 -7.74 56.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.801 0.334 . . . . 0.0 111.473 -178.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.27 22.16 30.44 Favored Glycine 0 N--CA 1.446 -0.633 0 C-N-CA 120.759 -0.734 . . . . 0.0 111.554 -179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.717 ' HG2' ' HB3' ' A' ' 43' ' ' SER . 9.9 pt-20 -89.2 124.85 63.79 Favored Pre-proline 0 C--N 1.325 -0.477 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 -179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -57.34 142.59 94.96 Favored 'Trans proline' 0 N--CA 1.473 0.305 0 C-N-CA 123.712 2.941 . . . . 0.0 114.489 -168.153 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.429 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.3 mt -120.47 147.39 45.18 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.165 -0.925 . . . . 0.0 110.524 175.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.459 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 23.1 mm-40 -63.26 106.63 0.91 Allowed 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.319 0.58 . . . . 0.0 111.059 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.42 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 18.5 m -113.13 130.94 56.03 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 114.786 -1.097 . . . . 0.0 109.915 -177.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.2 tptp -103.37 120.0 39.95 Favored 'General case' 0 N--CA 1.45 -0.427 0 C-N-CA 120.402 -0.519 . . . . 0.0 109.747 -178.277 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 71.9 mt -134.98 119.51 27.42 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 CA-C-N 116.178 -0.465 . . . . 0.0 110.356 177.563 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 9.6 ptmm? -108.67 142.8 38.63 Favored 'General case' 0 C--N 1.317 -0.831 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 174.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.652 HG12 ' H ' ' A' ' 57' ' ' GLU . 54.2 t 68.34 117.01 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.445 0 O-C-N 123.837 0.711 . . . . 0.0 110.175 -168.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 24.7 ptp -75.75 7.91 3.45 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 121.194 0.521 . . . . 0.0 111.519 -177.068 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.652 ' H ' HG12 ' A' ' 55' ' ' VAL . 49.4 mt-10 -125.05 159.19 31.94 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 109.12 -0.696 . . . . 0.0 109.12 -177.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 3.8 p -73.18 148.0 44.21 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.429 ' HE2' ' HB ' ' A' ' 55' ' ' VAL . 37.0 m170 -91.3 128.91 45.28 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.712 -0.395 . . . . 0.0 111.135 -163.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.614 ' HA ' ' O ' ' A' ' 63' ' ' THR . 78.7 Cg_endo -97.18 -174.11 0.21 Allowed 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.527 2.818 . . . . 0.0 112.946 179.391 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 91.8 m-20 63.46 91.11 0.07 Allowed 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.157 -179.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 95.99 -37.65 3.36 Favored Glycine 0 N--CA 1.449 -0.465 0 N-CA-C 111.129 -0.788 . . . . 0.0 111.129 -177.461 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.758 HG22 ' H ' ' A' ' 65' ' ' SER . 15.8 m -133.37 160.46 37.28 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -131.47 23.86 4.77 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.765 0.793 . . . . 0.0 109.453 173.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.758 ' H ' HG22 ' A' ' 63' ' ' THR . 19.3 m -112.65 167.98 10.04 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.149 -0.932 . . . . 0.0 111.927 -169.233 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.626 ' HB3' HG22 ' A' ' 28' ' ' VAL . . . -108.38 155.25 20.77 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 172.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -130.6 141.37 50.45 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-O 121.108 0.48 . . . . 0.0 110.391 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.572 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.56 123.09 2.79 Favored Glycine 0 N--CA 1.437 -1.288 0 N-CA-C 110.053 -1.219 . . . . 0.0 110.053 177.577 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.687 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.7 p -125.48 131.37 72.25 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.979 0 CA-C-O 120.959 0.409 . . . . 0.0 111.187 -174.728 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.561 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -114.33 142.47 46.28 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 115.762 -0.654 . . . . 0.0 110.294 -177.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 8.8 m -98.63 114.03 26.33 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 109.907 -0.405 . . . . 0.0 109.907 -178.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.501 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.1 m -123.01 165.97 18.44 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-N 115.883 -0.599 . . . . 0.0 110.197 -177.397 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 46.6 t -78.02 151.81 33.35 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 109.625 -0.509 . . . . 0.0 109.625 177.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 21.6 t -62.2 -29.26 46.2 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 109.235 -0.654 . . . . 0.0 109.235 177.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.524 ' HA ' ' HB2' ' A' ' 78' ' ' ASN . 4.3 mm-40 -66.29 -32.71 74.28 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 114.956 -1.02 . . . . 0.0 111.413 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 11.7 m-20 -60.39 -45.4 93.7 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-O 121.352 0.596 . . . . 0.0 109.512 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.564 ' CD1' ' HD3' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -72.04 -35.0 69.21 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.431 179.473 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.524 ' HB2' ' HA ' ' A' ' 75' ' ' GLU . 72.1 m-20 -67.03 -32.77 74.2 Favored 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 115.553 -0.749 . . . . 0.0 111.373 178.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -95.34 11.67 31.84 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 111.617 0.228 . . . . 0.0 111.617 -176.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 11.3 mpt_? 63.38 38.67 9.94 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.293 0.371 . . . . 0.0 111.986 177.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.1 mmmt -66.03 154.7 38.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.053 0.454 . . . . 0.0 111.266 177.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -119.92 139.79 51.88 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.466 -0.788 . . . . 0.0 109.211 178.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.407 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 78.9 m-85 -128.29 160.64 31.52 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-N 116.504 -0.316 . . . . 0.0 110.609 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.597 HG23 ' HA ' ' A' ' 44' ' ' GLN . 69.5 t -125.23 125.17 68.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.695 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.337 -178.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.414 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 33.9 t -105.76 132.28 52.07 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 109.452 -0.573 . . . . 0.0 109.452 177.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.588 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -121.14 134.0 55.22 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 109.865 -0.42 . . . . 0.0 109.865 -179.292 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.7 t -115.42 125.9 72.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 C-N-CA 120.959 -0.296 . . . . 0.0 110.846 -178.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 3.6 m -123.12 105.64 10.09 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-O 121.193 0.521 . . . . 0.0 110.451 -178.372 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.573 ' CG ' HD13 ' A' ' 37' ' ' LEU . 1.1 t60 -101.02 -10.53 20.44 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.086 -177.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.636 ' O ' ' HD3' ' A' ' 90' ' ' ARG . 1.0 OUTLIER 74.1 -0.7 3.28 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.631 0.729 . . . . 0.0 109.417 -170.973 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.457 ' HB3' HD11 ' A' ' 4' ' ' ILE . 24.0 t0 -72.56 -36.62 68.27 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 115.563 -0.744 . . . . 0.0 109.156 177.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -121.19 154.23 58.47 Favored Pre-proline 0 C--N 1.323 -0.587 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.372 178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -75.16 -21.86 15.14 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.956 2.437 . . . . 0.0 112.779 -177.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 51.1 m -130.1 119.58 18.84 Favored Pre-proline 0 C--N 1.323 -0.547 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.106 178.703 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.588 ' HB2' HG22 ' A' ' 86' ' ' THR . 50.6 Cg_endo -69.1 143.24 53.32 Favored 'Trans proline' 0 C--O 1.234 0.289 0 C-N-CA 122.866 2.377 . . . . 0.0 112.725 -177.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -81.2 142.0 33.64 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.03 -0.532 . . . . 0.0 110.562 -179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 19.7 ptpt -116.53 143.08 46.04 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-O 121.023 0.439 . . . . 0.0 111.059 179.529 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.542 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 48.1 mmtt -122.01 140.83 52.01 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.615 -0.721 . . . . 0.0 110.608 178.42 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -101.14 146.33 27.61 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 176.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . . . . . . . . . 13.6 tt -144.9 137.72 21.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.007 -0.677 . . . . 0.0 112.43 -177.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.0 p -159.21 142.9 14.91 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 170.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.564 ' HD3' ' CD1' ' A' ' 77' ' ' TRP . 20.8 pttp . . . . . 0 C--O 1.247 0.953 0 C-N-CA 120.162 -0.615 . . . . 0.0 110.444 -177.326 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.685 ' HA ' ' HA ' ' A' ' 32' ' ' ALA . 19.6 ptp . . . . . 0 N--CA 1.479 1.019 0 N-CA-C 110.11 -0.33 . . . . 0.0 110.11 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 99.57 -176.6 28.9 Favored Glycine 0 N--CA 1.445 -0.762 0 C-N-CA 120.768 -0.729 . . . . 0.0 111.772 -177.854 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 30.6 m-20 -82.69 125.55 31.36 Favored 'General case' 0 C--N 1.32 -0.691 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 177.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.54 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.3 mt -60.2 121.78 8.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 116.057 -0.519 . . . . 0.0 109.636 176.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.46 HD12 HD22 ' A' ' 30' ' ' ASN . 83.9 mt -104.15 131.02 51.87 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 121.115 0.484 . . . . 0.0 111.413 -176.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 5.1 t -121.59 119.45 31.94 Favored 'General case' 0 N--CA 1.443 -0.789 0 CA-C-N 115.267 -0.879 . . . . 0.0 109.648 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -116.29 132.27 56.71 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 178.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.419 HG21 ' HB3' ' A' ' 98' ' ' LYS . 6.6 p -112.45 131.02 55.78 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 121.234 0.54 . . . . 0.0 110.701 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 31.9 mm -117.74 123.96 29.26 Favored Pre-proline 0 C--N 1.319 -0.757 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.785 -177.427 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.477 ' HA ' HD11 ' A' ' 100' ' ' ILE . 43.5 Cg_endo -67.33 139.22 49.1 Favored 'Trans proline' 0 N--CA 1.458 -0.616 0 C-N-CA 122.203 1.935 . . . . 0.0 110.391 173.728 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.53 ' HB3' ' O ' ' A' ' 23' ' ' ASN . 56.5 Cg_endo -63.77 132.38 34.78 Favored 'Trans proline' 0 N--CA 1.456 -0.724 0 C-N-CA 122.053 1.836 . . . . 0.0 110.658 -179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.5 ' HB3' ' OD2' ' A' ' 15' ' ' ASP . 15.4 t -78.5 145.39 34.97 Favored 'General case' 0 C--N 1.306 -1.314 0 CA-C-N 115.229 -0.896 . . . . 0.0 108.852 -176.641 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -59.57 -29.39 67.91 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.323 -174.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.415 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -65.53 -46.45 79.54 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.434 174.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.5 ' OD2' ' HB3' ' A' ' 12' ' ' SER . 31.0 m-20 -64.96 -43.6 92.16 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.607 -179.381 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 75.5 mt -58.32 -34.65 50.76 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.192 0 CA-C-N 116.092 -0.504 . . . . 0.0 110.581 178.467 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 59.1 t80 -72.14 -42.39 66.05 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.879 -178.508 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.415 HD13 ' O ' ' A' ' 14' ' ' ALA . 6.9 mp -59.9 -48.84 80.06 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.36 -0.836 . . . . 0.0 112.198 -176.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 7.1 p -94.6 -10.61 31.46 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 111.783 0.29 . . . . 0.0 111.783 -177.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 93.2 mttt 64.54 18.83 11.57 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-O 121.3 0.571 . . . . 0.0 110.884 -178.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 32.6 t -139.02 144.94 39.09 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.457 -0.792 . . . . 0.0 109.116 179.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.41 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.16 134.93 33.47 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.274 -0.639 . . . . 0.0 109.274 176.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.66 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 39.1 m-80 -137.0 116.82 13.1 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.151 -174.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.51 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 0.2 OUTLIER -73.34 146.01 45.55 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 178.86 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 23.5 m -125.27 124.89 42.63 Favored 'General case' 0 C--N 1.313 -0.981 0 CA-C-N 116.091 -0.504 . . . . 0.0 110.683 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.682 ' O ' ' HA ' ' A' ' 67' ' ' LYS . 38.1 t -117.23 134.27 54.99 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.853 -0.612 . . . . 0.0 109.932 178.494 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -114.76 123.54 49.5 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 177.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.4 t -122.93 128.64 75.26 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.821 0.343 . . . . 0.0 110.363 179.153 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.509 ' HA ' ' HB3' ' A' ' 58' ' ' SER . 68.6 m -144.02 172.29 13.08 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.822 -179.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.46 HD22 HD12 ' A' ' 5' ' ' LEU . 96.5 m-20 60.27 52.19 5.05 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 123.893 0.746 . . . . 0.0 112.473 171.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.753 HD11 HD22 ' A' ' 37' ' ' LEU . 30.9 mt -75.87 153.43 36.78 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.16 177.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.685 ' HA ' ' HA ' ' A' ' 1' ' ' MET . . . -89.45 -50.64 5.98 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.53 0.205 . . . . 0.0 111.236 -177.511 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 22.2 p -88.14 156.12 19.42 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 120.671 0.272 . . . . 0.0 110.958 177.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 96.7 m-85 -90.78 16.21 9.71 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.044 -0.525 . . . . 0.0 110.807 -176.26 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.559 ' O ' ' HE1' ' A' ' 89' ' ' HIS . 63.3 mm-40 -69.59 169.97 11.63 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.105 -0.498 . . . . 0.0 110.612 179.059 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 13.3 m -67.59 144.46 55.57 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-N 116.451 -0.341 . . . . 0.0 110.219 177.022 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.753 HD22 HD11 ' A' ' 31' ' ' LEU . 58.9 tp -105.03 145.98 29.72 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-O 121.133 0.492 . . . . 0.0 110.683 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -128.41 148.95 50.73 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.082 179.057 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.641 HG21 ' HA3' ' A' ' 68' ' ' GLY . 21.5 mm -120.06 135.14 61.29 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.721 0 N-CA-C 108.22 -1.03 . . . . 0.0 108.22 176.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.8 m -124.72 135.01 52.64 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 120.828 0.347 . . . . 0.0 110.832 -178.332 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.451 ' CH2' ' HB2' ' A' ' 85' ' ' CYS . 66.2 m95 -125.83 138.01 53.8 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.85 -0.614 . . . . 0.0 110.104 174.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.74 158.19 41.94 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.885 -0.598 . . . . 0.0 109.669 178.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.2 t -78.54 160.56 27.57 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 48.2 tp60 -55.54 -32.0 62.59 Favored 'General case' 0 C--N 1.321 -0.638 0 CA-C-O 121.089 0.471 . . . . 0.0 111.086 -179.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -76.03 -4.77 43.13 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.713 -0.676 . . . . 0.0 112.425 -178.036 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.04 22.97 28.71 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.479 -0.867 . . . . 0.0 112.394 -179.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -92.37 122.12 65.17 Favored Pre-proline 0 C--N 1.327 -0.386 0 N-CA-C 109.895 -0.409 . . . . 0.0 109.895 178.756 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_endo -64.78 144.09 82.43 Favored 'Trans proline' 0 C--N 1.342 0.234 0 C-N-CA 122.772 2.315 . . . . 0.0 112.786 -177.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.403 ' HA ' HD23 ' A' ' 49' ' ' LEU . 5.7 mt -120.4 146.39 46.24 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 121.41 0.624 . . . . 0.0 111.783 -178.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -69.33 118.2 11.92 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.945 -1.025 . . . . 0.0 110.936 -179.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.548 HG22 HD11 ' A' ' 53' ' ' ILE . 1.8 m -143.72 130.83 20.65 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.096 -179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.3 tttm -117.66 120.98 39.65 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 120.698 0.285 . . . . 0.0 110.713 -179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.548 HD11 HG22 ' A' ' 51' ' ' THR . 4.0 mp -136.06 138.44 47.32 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 112.369 0.507 . . . . 0.0 112.369 -175.661 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -126.99 124.2 38.89 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.873 -0.603 . . . . 0.0 109.52 166.462 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.553 HG11 ' HB2' ' A' ' 66' ' ' ALA . 6.2 p -173.77 135.91 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.24 0 CA-C-O 121.085 0.469 . . . . 0.0 111.231 -179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 50.7 tpp -108.06 -51.11 2.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.898 176.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -122.82 155.35 36.76 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 175.5 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 65' ' ' SER . 63.0 m -123.28 133.95 54.13 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 121.395 0.617 . . . . 0.0 112.21 -178.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.609 ' O ' ' HB ' ' A' ' 63' ' ' THR . 11.1 m80 -149.77 130.23 6.9 Favored Pre-proline 0 C--N 1.324 -0.526 0 CA-C-N 115.068 -0.969 . . . . 0.0 108.907 176.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.477 ' HD3' ' HB3' ' A' ' 29' ' ' SER . 63.0 Cg_endo -73.64 174.67 11.85 Favored 'Trans proline' 0 CA--C 1.531 0.347 0 C-N-CA 122.18 1.92 . . . . 0.0 114.438 -168.168 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.412 ' CG ' ' H ' ' A' ' 62' ' ' GLY . 60.1 t30 77.02 -152.55 0.03 OUTLIER 'General case' 0 N--CA 1.473 0.695 0 CA-C-N 114.903 -1.044 . . . . 0.0 109.951 -176.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . 0.412 ' H ' ' CG ' ' A' ' 61' ' ' ASN . . . -74.15 60.58 2.26 Favored Glycine 0 C--N 1.335 0.513 0 N-CA-C 111.24 -0.744 . . . . 0.0 111.24 176.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.756 HG22 ' H ' ' A' ' 64' ' ' PHE . 4.5 m -142.11 177.23 8.37 Favored 'General case' 0 N--CA 1.444 -0.763 0 N-CA-C 109.839 -0.43 . . . . 0.0 109.839 -168.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.756 ' H ' HG22 ' A' ' 63' ' ' THR . 6.7 t80 -78.55 35.23 0.23 Allowed 'General case' 0 C--O 1.217 -0.625 0 C-N-CA 124.725 1.21 . . . . 0.0 113.952 -162.173 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 58' ' ' SER . 21.1 p -95.49 172.85 7.82 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.126 -0.984 . . . . 0.0 109.24 -172.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.553 ' HB2' HG11 ' A' ' 55' ' ' VAL . . . -103.21 143.37 32.72 Favored 'General case' 0 CA--C 1.507 -0.686 0 CA-C-O 121.478 0.656 . . . . 0.0 111.974 -163.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.682 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 97.8 mttt -130.18 139.09 50.88 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.521 -1.218 . . . . 0.0 108.919 177.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.641 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -119.94 115.52 3.01 Favored Glycine 0 N--CA 1.441 -0.996 0 C-N-CA 120.439 -0.886 . . . . 0.0 111.211 176.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.51 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -108.2 120.74 60.09 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 CA-C-O 120.849 0.357 . . . . 0.0 110.209 178.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.66 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.97 132.45 56.65 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.674 -0.694 . . . . 0.0 109.905 -179.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 20.0 m -98.0 118.95 35.74 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.191 0.52 . . . . 0.0 110.829 -174.684 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.445 HG11 HD21 ' A' ' 24' ' ' LEU . 3.4 m -124.43 167.73 18.01 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.323 -0.853 . . . . 0.0 110.152 -176.39 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 24.6 t -78.21 149.34 33.69 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.003 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 19.1 t -65.48 -27.28 41.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 CA-C-N 115.835 -0.62 . . . . 0.0 109.802 -177.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -63.12 -35.66 81.03 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.943 178.141 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 50.0 m-20 -65.02 -42.23 94.6 Favored 'General case' 0 CA--C 1.517 -0.31 0 N-CA-C 109.364 -0.606 . . . . 0.0 109.364 -178.01 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.525 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -73.8 -36.52 65.02 Favored 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.431 179.214 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 -73.16 -21.15 60.76 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.871 -0.604 . . . . 0.0 111.913 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.3 m-20 -94.96 7.08 47.22 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 120.953 0.406 . . . . 0.0 110.209 176.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.5 ttp180 54.75 39.43 31.36 Favored 'General case' 0 CA--C 1.528 0.11 0 CA-C-N 115.164 -0.925 . . . . 0.0 111.195 -179.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 28.3 mmmt -65.1 164.78 12.33 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.782 -0.644 . . . . 0.0 110.339 176.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 15.4 mp0 -108.73 139.2 43.88 Favored 'General case' 0 C--N 1.318 -0.785 0 CA-C-N 116.026 -0.534 . . . . 0.0 110.616 179.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.525 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 68.3 m-85 -124.77 148.9 47.86 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 115.443 -0.799 . . . . 0.0 109.723 175.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.443 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 71.1 t -117.6 127.17 75.03 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.879 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.842 -174.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.451 ' HB2' ' CH2' ' A' ' 41' ' ' TRP . 43.8 t -105.44 136.68 44.56 Favored 'General case' 0 N--CA 1.44 -0.965 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 172.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.537 HG23 ' HG2' ' A' ' 97' ' ' LYS . 1.0 OUTLIER -125.93 130.0 50.42 Favored 'General case' 0 C--N 1.309 -1.171 0 N-CA-C 109.276 -0.638 . . . . 0.0 109.276 178.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.6 t -100.75 124.08 54.12 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 109.523 177.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -123.28 92.48 3.7 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-O 121.74 0.781 . . . . 0.0 110.395 -177.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.559 ' HE1' ' O ' ' A' ' 35' ' ' GLU . 10.6 t60 -97.9 -9.22 26.68 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.175 -0.921 . . . . 0.0 110.294 -179.057 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 65.33 17.66 11.07 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.542 -174.207 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -82.99 -27.89 30.11 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.823 -1.08 . . . . 0.0 109.001 178.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.52 153.87 77.97 Favored Pre-proline 0 C--N 1.322 -0.609 0 CA-C-N 114.585 -1.189 . . . . 0.0 110.177 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 64.4 Cg_endo -76.23 -22.78 12.43 Favored 'Trans proline' 0 N--CA 1.465 -0.185 0 C-N-CA 123.076 2.517 . . . . 0.0 112.329 -177.58 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.403 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 10.6 p -113.82 105.69 54.35 Favored Pre-proline 0 C--N 1.322 -0.617 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.432 177.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.509 ' HB2' HG22 ' A' ' 86' ' ' THR . 30.9 Cg_endo -64.14 141.49 76.47 Favored 'Trans proline' 0 C--O 1.233 0.247 0 C-N-CA 122.573 2.182 . . . . 0.0 111.738 179.491 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -83.73 128.0 34.2 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.394 -0.366 . . . . 0.0 110.396 -179.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.537 ' HG2' HG23 ' A' ' 86' ' ' THR . 49.7 mtmt -106.88 139.33 41.47 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.385 0.612 . . . . 0.0 111.074 178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.443 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 42.2 mmtt -118.15 130.71 56.26 Favored 'General case' 0 C--N 1.316 -0.863 0 CA-C-N 115.084 -0.962 . . . . 0.0 110.686 179.282 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -101.45 121.87 42.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.025 -0.534 . . . . 0.0 109.947 179.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 10' ' ' PRO . 14.0 tt -123.79 139.22 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 CA-C-O 121.114 0.483 . . . . 0.0 110.656 -178.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 16.1 t -158.1 150.65 22.37 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.474 -0.785 . . . . 0.0 109.218 179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.402 ' HE2' ' O ' ' A' ' 77' ' ' TRP . 37.2 ttpt . . . . . 0 C--O 1.246 0.919 0 CA-C-O 118.721 -0.657 . . . . 0.0 109.799 179.229 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.8 ptt? . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 120.932 0.396 . . . . 0.0 111.032 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -100.24 28.46 15.66 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.742 -0.742 . . . . 0.0 111.313 179.195 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -127.27 144.32 51.07 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 115.352 -0.424 . . . . 0.0 109.922 -176.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.55 HG12 ' HA ' ' A' ' 31' ' ' LEU . 76.1 mt -61.37 126.2 18.96 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.461 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 172.571 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 83.2 mt -104.69 129.74 52.83 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-O 121.228 0.537 . . . . 0.0 110.022 -179.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.569 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 3.2 t -125.24 127.86 47.4 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 115.808 -0.633 . . . . 0.0 109.72 -179.038 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 86.8 m-85 -123.91 142.06 51.48 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.251 -177.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.43 ' HB ' HD12 ' A' ' 100' ' ' ILE . 16.8 p -113.6 135.0 54.39 Favored 'General case' 0 C--N 1.316 -0.874 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.523 179.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.3 mp -117.14 121.9 31.87 Favored Pre-proline 0 C--N 1.32 -0.714 0 N-CA-C 109.882 -0.414 . . . . 0.0 109.882 179.48 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 58.7 Cg_endo -71.1 138.89 34.52 Favored 'Trans proline' 0 N--CA 1.459 -0.525 0 C-N-CA 122.665 2.243 . . . . 0.0 111.682 177.403 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HG2' HD11 ' A' ' 16' ' ' ILE . 58.5 Cg_endo -68.62 146.88 68.71 Favored 'Trans proline' 0 N--CA 1.461 -0.43 0 C-N-CA 122.467 2.111 . . . . 0.0 111.523 178.156 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.7 m -83.14 142.6 31.11 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.118 -178.163 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 69.8 t80 -54.02 -43.77 70.38 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.608 0.242 . . . . 0.0 111.517 -172.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.658 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.88 -40.64 95.43 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 0.0 110.945 -179.719 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.21 -39.38 93.86 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.09 -179.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.426 HD11 ' HG2' ' A' ' 11' ' ' PRO . 71.6 mt -64.55 -32.89 59.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 115.569 -0.741 . . . . 0.0 110.602 176.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -71.59 -37.05 71.02 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.327 -177.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.658 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 24.2 mt -67.41 -42.68 82.88 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.852 -177.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 8.8 p -85.94 -21.28 27.99 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 116.289 -0.414 . . . . 0.0 111.427 -179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 20' ' ' LYS . 27.9 mmtp 66.97 6.19 4.54 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-N 115.705 -0.68 . . . . 0.0 111.213 -175.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 47.2 p -138.62 125.62 21.25 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 175.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.51 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -70.34 138.26 51.28 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.491 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.6 p30 -117.27 128.4 55.03 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-O 121.229 0.538 . . . . 0.0 110.227 -177.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.711 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 77.7 mt -91.22 122.63 34.01 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.635 179.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 56.5 m -111.19 123.82 50.96 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-O 121.266 0.555 . . . . 0.0 111.081 -176.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.479 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.1 t -117.89 137.21 52.96 Favored 'General case' 0 C--N 1.322 -0.597 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.559 -179.761 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -121.56 123.58 42.32 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.033 -0.729 . . . . 0.0 109.033 177.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 87' ' ' VAL . 22.5 t -117.25 120.6 65.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 109.991 -0.374 . . . . 0.0 109.991 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 13.0 p -136.08 176.56 8.58 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.413 -0.358 . . . . 0.0 111.005 -173.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.412 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 12.7 m120 56.98 50.6 11.89 Favored 'General case' 0 N--CA 1.468 0.442 0 O-C-N 123.763 0.664 . . . . 0.0 111.769 175.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.631 HD11 HD22 ' A' ' 37' ' ' LEU . 39.0 mt -74.5 128.91 36.73 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.91 -0.586 . . . . 0.0 109.683 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -66.81 -49.94 64.21 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.292 -176.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.434 HG22 ' OD2' ' A' ' 91' ' ' ASP . 5.8 t -113.15 147.61 37.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 173.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -93.95 132.21 38.63 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 121.353 0.596 . . . . 0.0 111.926 -176.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.817 ' HG2' ' H ' ' A' ' 36' ' ' THR . 35.3 tt0 -171.72 -171.5 0.91 Allowed 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 107.318 -1.364 . . . . 0.0 107.318 175.09 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.817 ' H ' ' HG2' ' A' ' 35' ' ' GLU . 7.9 t -60.62 153.51 23.57 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-O 121.105 0.478 . . . . 0.0 110.579 177.235 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.631 HD22 HD11 ' A' ' 31' ' ' LEU . 43.6 tp -136.93 148.65 47.11 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.258 -0.428 . . . . 0.0 109.86 -179.38 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.4 HD22 ' HA ' ' A' ' 38' ' ' ASN . 2.1 t-20 -137.9 155.07 49.33 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 115.945 -0.571 . . . . 0.0 109.513 -177.253 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.489 HG22 HG21 ' A' ' 51' ' ' THR . 3.0 mp -120.76 135.34 61.27 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 N-CA-C 108.204 -1.035 . . . . 0.0 108.204 174.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 15.3 m -129.6 122.86 29.94 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 121.049 -0.261 . . . . 0.0 110.658 -178.508 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.612 ' HD1' HG23 ' A' ' 51' ' ' THR . 79.7 m95 -106.11 136.94 44.91 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.165 0.507 . . . . 0.0 110.829 178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.56 141.0 18.76 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 115.256 -0.884 . . . . 0.0 108.87 176.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.548 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 44.6 t -70.57 151.3 45.18 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.987 -0.746 . . . . 0.0 108.987 175.636 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 49.9 tt0 -64.57 -21.25 66.65 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.693 -177.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.413 ' HB2' ' HG3' ' A' ' 47' ' ' GLU . 3.9 m -75.42 -4.72 41.14 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.211 -0.904 . . . . 0.0 111.108 178.799 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.68 23.16 26.66 Favored Glycine 0 C--N 1.335 0.511 0 C-N-CA 120.674 -0.774 . . . . 0.0 111.852 -178.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.548 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 23.7 mt-10 -95.46 120.77 63.2 Favored Pre-proline 0 C--N 1.325 -0.471 0 N-CA-C 109.533 -0.543 . . . . 0.0 109.533 -178.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 11.8 Cg_exo -70.63 141.99 43.0 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.93 2.42 . . . . 0.0 112.238 -177.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.402 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.5 mt -126.53 141.5 51.85 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 116.316 -0.402 . . . . 0.0 111.103 179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.8 mt-10 -80.67 107.25 13.32 Favored 'General case' 0 N--CA 1.446 -0.658 0 CA-C-N 115.856 -0.611 . . . . 0.0 110.356 177.864 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.612 HG23 ' HD1' ' A' ' 41' ' ' TRP . 9.6 m -97.3 132.46 43.02 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.345 -0.843 . . . . 0.0 109.489 179.894 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -111.47 123.02 49.35 Favored 'General case' 0 N--CA 1.445 -0.724 0 C-N-CA 120.177 -0.609 . . . . 0.0 110.349 -178.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.455 HG13 ' HA2' ' A' ' 68' ' ' GLY . 4.8 mp -128.19 125.57 64.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 108.453 -0.944 . . . . 0.0 108.453 174.952 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 55' ' ' VAL . 21.2 ptmt -96.01 138.95 32.89 Favored 'General case' 0 N--CA 1.446 -0.642 0 N-CA-C 109.14 -0.689 . . . . 0.0 109.14 178.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.554 HG12 ' H ' ' A' ' 57' ' ' GLU . 58.9 t 71.6 116.49 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 CA-C-N 115.103 -0.953 . . . . 0.0 109.099 -167.241 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 90.9 mmm -75.95 9.2 2.55 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 121.422 0.63 . . . . 0.0 111.328 -174.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.554 ' H ' HG12 ' A' ' 55' ' ' VAL . 48.4 mt-10 -129.11 158.01 40.15 Favored 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.523 -178.973 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.8 t -74.48 151.77 39.51 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.465 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 10.7 m170 -91.08 128.09 48.98 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 116.445 -0.343 . . . . 0.0 110.286 -166.229 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.561 ' HA ' ' O ' ' A' ' 63' ' ' THR . 88.4 Cg_endo -100.13 -141.57 0.02 OUTLIER 'Trans proline' 0 N--CA 1.451 -0.991 0 C-N-CA 123.612 2.875 . . . . 0.0 114.258 -173.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.462 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 49.1 m-80 76.08 -89.7 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 124.056 0.942 . . . . 0.0 110.379 -176.381 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . -115.59 8.4 19.86 Favored Glycine 0 N--CA 1.447 -0.622 0 N-CA-C 110.457 -1.057 . . . . 0.0 110.457 174.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.721 HG22 ' H ' ' A' ' 65' ' ' SER . 4.9 m -124.62 157.5 35.35 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.565 -0.818 . . . . 0.0 109.814 -175.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 84.0 m-85 -132.35 22.64 4.41 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 172.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.721 ' H ' HG22 ' A' ' 63' ' ' THR . 7.1 m -118.64 154.82 32.05 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.764 -163.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -115.15 160.56 19.54 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.936 174.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 84.7 mttt -130.46 140.93 50.53 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 109.866 -0.42 . . . . 0.0 109.866 175.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.455 ' HA2' HG13 ' A' ' 53' ' ' ILE . . . -141.01 124.11 2.48 Favored Glycine 0 N--CA 1.439 -1.127 0 N-CA-C 110.908 -0.877 . . . . 0.0 110.908 -177.374 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.711 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 1.4 p -119.0 135.98 57.66 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.942 0 CA-C-O 121.011 0.434 . . . . 0.0 111.354 -174.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.491 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.9 147.87 40.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.708 -177.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 13.8 m -99.44 114.34 27.22 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 120.839 0.352 . . . . 0.0 110.195 179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.51 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 1.8 m -122.34 166.88 16.52 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.17 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 14.5 m -86.02 145.52 27.05 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.411 ' H ' HG23 ' A' ' 74' ' ' VAL . 2.4 t -60.06 -33.57 53.59 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.256 0 CA-C-O 121.676 0.751 . . . . 0.0 109.517 -178.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.536 ' CD ' ' H ' ' A' ' 75' ' ' GLU . 1.8 mp0 -57.1 -37.44 71.94 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.893 178.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -62.34 -42.37 99.33 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-O 121.724 0.773 . . . . 0.0 109.015 178.109 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.541 ' HZ3' ' HD2' ' A' ' 83' ' ' PHE . 0.1 OUTLIER -69.87 -41.01 75.37 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 114.685 -1.143 . . . . 0.0 110.347 178.849 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -71.96 -21.79 61.54 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.323 -0.853 . . . . 0.0 111.481 -178.432 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -97.53 9.12 43.26 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.801 0.334 . . . . 0.0 110.58 177.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 72.0 mtt180 58.51 36.86 25.51 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.431 -0.804 . . . . 0.0 111.643 175.451 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.415 ' HE2' ' HB3' ' A' ' 81' ' ' LYS . 51.2 mtpt -71.34 162.8 28.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 120.81 0.338 . . . . 0.0 110.8 -179.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 56.4 mp0 -106.98 137.8 44.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-O 121.188 0.518 . . . . 0.0 110.575 -177.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.541 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 76.1 m-85 -125.31 146.34 49.61 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.692 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.548 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 99.5 t -121.17 129.02 76.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.569 -0.742 . . . . 0.0 110.808 -176.272 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.757 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.2 p -107.11 123.28 48.0 Favored 'General case' 0 C--N 1.317 -0.818 0 N-CA-C 109.055 -0.72 . . . . 0.0 109.055 171.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.522 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -112.17 131.1 55.66 Favored 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.107 -178.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.553 HG11 HG11 ' A' ' 28' ' ' VAL . 40.2 t -105.46 127.33 60.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.683 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.989 -176.173 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 15.8 p -120.46 90.6 3.36 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-O 121.515 0.674 . . . . 0.0 110.669 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.555 ' CD2' ' HB2' ' A' ' 91' ' ' ASP . 11.3 t60 -99.44 -10.17 22.52 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.237 -0.892 . . . . 0.0 111.658 -175.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.523 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 8.2 tpt180 74.04 0.68 3.68 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-O 122.158 0.98 . . . . 0.0 109.853 -174.034 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.555 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 12.2 t70 -73.76 -36.4 65.09 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 110.286 -178.398 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -129.34 154.84 80.71 Favored Pre-proline 0 C--N 1.322 -0.587 0 CA-C-N 115.286 -0.87 . . . . 0.0 110.701 -177.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 49.3 Cg_endo -72.17 -31.37 12.07 Favored 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.929 2.419 . . . . 0.0 112.434 -178.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.402 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 21.0 m -112.63 109.17 53.46 Favored Pre-proline 0 C--N 1.319 -0.746 0 CA-C-N 115.659 -0.701 . . . . 0.0 109.642 -179.626 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.522 ' HB2' HG22 ' A' ' 86' ' ' THR . 17.8 Cg_endo -59.68 140.27 92.75 Favored 'Trans proline' 0 C--O 1.235 0.346 0 C-N-CA 122.569 2.179 . . . . 0.0 111.789 -178.468 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 42.4 mt-30 -82.2 143.49 31.36 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.452 -178.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmt -128.59 144.07 51.08 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.439 -177.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.757 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 69.6 mmtt -126.28 146.59 49.95 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.197 177.269 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -109.26 129.69 55.5 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.1 -0.5 . . . . 0.0 109.921 -179.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 8' ' ' THR . 15.0 tt -131.31 138.73 52.54 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-O 120.84 0.352 . . . . 0.0 110.57 -178.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 50.3 m -157.14 150.41 23.95 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.851 -0.613 . . . . 0.0 109.776 -177.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.43 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 22.2 tptm . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.359 -0.829 . . . . 0.0 110.661 -179.759 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.9 mpt? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.934 -0.395 . . . . 0.0 109.934 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.07 55.29 0.99 Allowed Glycine 0 N--CA 1.446 -0.635 0 C-N-CA 120.553 -0.832 . . . . 0.0 111.967 178.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -98.03 113.2 25.0 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 120.661 0.267 . . . . 0.0 110.428 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.645 HG23 HD23 ' A' ' 31' ' ' LEU . 93.8 mt -84.3 125.63 40.24 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.807 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.163 174.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . 0.483 HD23 ' HB2' ' A' ' 30' ' ' ASN . 1.5 mm? -100.81 130.52 46.85 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.183 0.516 . . . . 0.0 110.245 -179.594 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.551 HG21 HG11 ' A' ' 87' ' ' VAL . 23.4 p -117.88 135.45 54.09 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 111.025 -178.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -133.43 143.54 48.93 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.894 -0.593 . . . . 0.0 110.519 -179.749 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 2.6 p -113.84 136.97 52.28 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.22 -0.445 . . . . 0.0 110.199 176.368 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 38.6 mm -117.27 125.03 28.5 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-O 120.885 0.374 . . . . 0.0 110.699 -176.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 83.3 Cg_endo -76.43 140.15 21.4 Favored 'Trans proline' 0 N--CA 1.462 -0.365 0 C-N-CA 123.075 2.517 . . . . 0.0 112.212 178.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.78 152.11 74.13 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 122.949 2.432 . . . . 0.0 112.249 177.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.451 ' HB3' ' OD1' ' A' ' 15' ' ' ASP . 47.9 t -90.98 151.68 20.98 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.308 178.664 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.562 ' HE1' ' HE3' ' A' ' 102' ' ' LYS . 58.2 m-85 -60.93 -31.86 71.38 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.525 -0.762 . . . . 0.0 111.242 -174.442 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -70.2 -38.5 75.33 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.283 -0.417 . . . . 0.0 111.175 177.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.628 ' HA ' HD12 ' A' ' 18' ' ' LEU . 9.3 m-20 -74.48 -24.96 59.09 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.363 0.602 . . . . 0.0 110.72 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.411 HG12 ' HA ' ' A' ' 22' ' ' ALA . 69.8 mt -74.48 -25.27 19.23 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.792 0 CA-C-O 121.651 0.739 . . . . 0.0 109.384 172.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 11.3 t80 -73.7 -47.62 38.18 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.134 -0.939 . . . . 0.0 112.355 -175.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.766 HD13 ' H ' ' A' ' 19' ' ' SER . 0.0 OUTLIER -77.94 -36.36 49.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.362 0.601 . . . . 0.0 111.547 -169.971 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.766 ' H ' HD13 ' A' ' 18' ' ' LEU . 24.1 t -89.85 -8.45 51.95 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.988 179.007 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 53.3 mttm 59.07 16.32 4.67 Favored 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 115.789 -0.641 . . . . 0.0 112.015 -178.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.1 m -139.77 152.81 46.89 Favored 'General case' 0 C--N 1.319 -0.76 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.516 ' O ' HG22 ' A' ' 72' ' ' VAL . . . -94.09 122.61 36.78 Favored 'General case' 0 C--N 1.319 -0.755 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 175.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.473 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 19.9 m120 -106.28 128.35 53.91 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.429 0.633 . . . . 0.0 111.071 -174.285 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.576 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 85.9 mt -84.29 138.01 33.15 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 114.887 -1.051 . . . . 0.0 109.886 178.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.438 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 89.7 m -124.92 117.63 24.49 Favored 'General case' 0 C--N 1.317 -0.813 0 CA-C-O 121.38 0.61 . . . . 0.0 110.497 179.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.574 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.6 t -109.93 131.99 54.56 Favored 'General case' 0 C--N 1.313 -1.018 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.417 176.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.539 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.1 tt -126.24 130.67 51.37 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 121.171 0.51 . . . . 0.0 110.54 178.788 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.529 HG12 HD21 ' A' ' 31' ' ' LEU . 44.9 t -122.36 125.28 72.57 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 115.738 -0.664 . . . . 0.0 109.754 -178.691 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . 0.55 ' HB3' ' OG ' ' A' ' 65' ' ' SER . 14.5 p -138.91 176.26 8.84 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 116.539 -0.301 . . . . 0.0 111.226 -175.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . 0.483 ' HB2' HD23 ' A' ' 5' ' ' LEU . 3.8 m-20 59.05 46.7 13.0 Favored 'General case' 0 N--CA 1.464 0.237 0 O-C-N 123.644 0.59 . . . . 0.0 111.041 178.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.668 ' HB3' ' CE1' ' A' ' 89' ' ' HIS . 15.8 mt -79.74 160.23 26.3 Favored 'General case' 0 C--N 1.319 -0.732 0 CA-C-N 115.932 -0.576 . . . . 0.0 109.99 179.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.79 -22.34 15.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 176.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.694 ' HA ' ' CE1' ' A' ' 89' ' ' HIS . 0.2 OUTLIER 68.25 52.27 0.66 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 112.87 -1.968 . . . . 0.0 112.68 163.45 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -84.02 -6.61 59.44 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.647 173.236 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.519 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 7.9 tp10 -164.27 168.02 19.24 Favored 'General case' 0 CA--C 1.534 0.339 0 CA-C-N 115.358 -0.837 . . . . 0.0 108.91 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' A' ' 56' ' ' MET . 7.1 p -69.13 171.36 8.43 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 120.948 0.404 . . . . 0.0 111.794 178.645 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.667 HD13 ' N ' ' A' ' 38' ' ' ASN . 1.9 tm? -122.71 161.29 24.16 Favored 'General case' 0 N--CA 1.456 -0.17 0 CA-C-O 121.251 0.548 . . . . 0.0 110.65 -175.69 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.667 ' N ' HD13 ' A' ' 37' ' ' LEU . 4.7 t-20 -152.75 154.22 34.79 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.846 -1.168 . . . . 0.0 107.846 -179.231 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 20.2 mm -119.74 135.82 58.86 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.58 0 N-CA-C 108.974 -0.75 . . . . 0.0 108.974 -179.002 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 13.7 m -132.06 135.16 46.28 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 120.941 -0.303 . . . . 0.0 110.732 -179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.574 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 56.9 m95 -116.74 138.6 51.36 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 121.024 0.44 . . . . 0.0 110.818 177.406 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -150.23 162.29 40.77 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.738 -0.665 . . . . 0.0 110.322 177.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.502 ' HB3' ' HB2' ' A' ' 47' ' ' GLU . 36.6 t -74.82 168.07 20.6 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 174.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -63.67 -24.35 67.75 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.928 0.394 . . . . 0.0 111.391 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 67.7 m -83.55 3.38 32.7 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.537 -0.302 . . . . 0.0 111.408 177.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 84.48 22.13 54.7 Favored Glycine 0 N--CA 1.45 -0.418 0 C-N-CA 120.814 -0.708 . . . . 0.0 111.861 -179.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.502 ' HB2' ' HB3' ' A' ' 43' ' ' SER . 36.3 mt-10 -87.46 121.78 70.98 Favored Pre-proline 0 C--N 1.324 -0.518 0 N-CA-C 110.096 -0.335 . . . . 0.0 110.096 -178.334 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.415 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 48.3 Cg_exo -56.38 142.67 88.42 Favored 'Trans proline' 0 C--O 1.234 0.313 0 C-N-CA 123.326 2.684 . . . . 0.0 113.28 -175.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 49' ' ' LEU . 4.5 mt -123.17 146.8 47.47 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.713 178.226 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -62.63 108.38 1.14 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.96 -179.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.449 ' OG1' ' HB2' ' A' ' 41' ' ' TRP . 8.5 m -131.56 131.08 43.05 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.145 -177.145 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 49.7 tptt -113.94 122.73 47.86 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 178.155 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.493 ' CD1' ' HB ' ' A' ' 39' ' ' ILE . 50.6 mm -122.31 120.14 60.32 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 121.115 0.483 . . . . 0.0 111.141 -178.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 66.4 mmtt -107.52 136.83 46.63 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.259 174.427 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.709 HG12 ' H ' ' A' ' 57' ' ' GLU . 36.9 t 72.19 111.6 0.04 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.005 -178.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.429 ' O ' ' HB ' ' A' ' 36' ' ' THR . 92.8 mmm -74.72 10.16 1.51 Allowed 'General case' 0 N--CA 1.469 0.51 0 CA-C-O 121.553 0.692 . . . . 0.0 111.154 177.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.709 ' H ' HG12 ' A' ' 55' ' ' VAL . 42.7 mt-10 -121.46 157.26 30.99 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 -177.937 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 14.3 m -75.06 146.56 41.4 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -174.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.493 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 50.2 m170 -91.85 129.27 42.74 Favored Pre-proline 0 C--N 1.324 -0.536 0 CA-C-N 115.864 -0.607 . . . . 0.0 110.528 -168.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.656 ' HA ' ' O ' ' A' ' 63' ' ' THR . 10.4 Cg_endo -91.4 -148.82 0.03 OUTLIER 'Trans proline' 0 N--CA 1.449 -1.121 0 C-N-CA 123.565 2.843 . . . . 0.0 112.112 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 93.2 m-20 63.58 68.38 0.6 Allowed 'General case' 0 C--O 1.234 0.281 0 CA-C-O 121.13 0.49 . . . . 0.0 110.186 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 79.84 12.63 83.28 Favored Glycine 0 N--CA 1.448 -0.507 0 N-CA-C 111.476 -0.649 . . . . 0.0 111.476 -178.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.656 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 3.3 m -145.41 153.71 41.49 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 -177.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 98.9 m-85 -132.2 22.93 4.47 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 174.628 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.638 ' H ' HG22 ' A' ' 63' ' ' THR . 8.2 m -129.91 171.91 12.24 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.443 -0.799 . . . . 0.0 112.073 -165.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.539 ' O ' ' HA ' ' A' ' 27' ' ' LEU . . . -109.12 150.03 28.46 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.369 175.401 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.505 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 20.4 ttmm -131.58 139.31 49.16 Favored 'General case' 0 C--N 1.322 -0.625 0 N-CA-C 110.013 -0.365 . . . . 0.0 110.013 -179.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -132.92 128.76 5.23 Favored Glycine 0 N--CA 1.445 -0.714 0 C-N-CA 120.88 -0.676 . . . . 0.0 111.61 177.325 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.576 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 59.6 t -114.43 125.01 71.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 120.728 0.299 . . . . 0.0 111.24 -175.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.473 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -118.44 146.76 44.22 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.068 175.816 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 14.4 m -100.33 122.29 42.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-O 120.825 0.345 . . . . 0.0 110.662 179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.516 HG22 ' O ' ' A' ' 22' ' ' ALA . 1.5 m -122.42 167.24 16.21 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-N 116.251 -0.431 . . . . 0.0 110.36 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 1.1 m -71.76 143.01 49.72 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 115.971 -0.559 . . . . 0.0 109.85 -179.493 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 25.4 t -61.8 -35.25 66.63 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 CA-C-O 121.818 0.818 . . . . 0.0 108.85 175.581 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 25.5 mt-10 -64.89 -32.35 74.02 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 114.344 -1.298 . . . . 0.0 111.787 177.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 63.9 m-20 -62.02 -47.62 83.93 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 175.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.584 ' HH2' HG12 ' A' ' 100' ' ' ILE . 0.1 OUTLIER -67.87 -42.83 80.66 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.966 -1.016 . . . . 0.0 110.754 -179.237 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -66.64 -28.0 68.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.534 -179.203 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -89.43 7.39 36.22 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.602 0.239 . . . . 0.0 110.739 178.154 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 67.7 mtp180 64.81 37.32 7.37 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.919 -0.582 . . . . 0.0 112.007 176.53 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HB3' ' HE3' ' A' ' 81' ' ' LYS . 26.7 mmmt -72.44 160.01 33.04 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.185 178.434 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 30.0 tt0 -124.06 138.82 54.39 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.758 -0.656 . . . . 0.0 109.806 -177.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.411 ' HD1' ' HA ' ' A' ' 43' ' ' SER . 90.9 m-85 -122.73 160.98 24.79 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.705 -178.282 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . . . . . . . . . 96.1 t -124.62 128.89 73.76 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.481 0 CA-C-O 121.056 0.455 . . . . 0.0 110.854 -175.64 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.744 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 26.4 p -106.5 142.98 35.27 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.314 -0.403 . . . . 0.0 110.02 176.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.459 HG23 ' HG2' ' A' ' 97' ' ' LYS . 0.3 OUTLIER -122.48 121.59 36.93 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.255 0.55 . . . . 0.0 110.999 177.851 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.645 HG23 HD21 ' A' ' 37' ' ' LEU . 0.5 OUTLIER -104.27 134.96 44.13 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.892 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.353 179.641 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -127.8 92.92 3.57 Favored 'General case' 0 N--CA 1.446 -0.636 0 CA-C-O 121.307 0.575 . . . . 0.0 110.425 -173.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.694 ' CE1' ' HA ' ' A' ' 33' ' ' THR . 3.2 t-160 -99.03 -10.98 21.92 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.03 -177.324 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 60.25 9.78 2.07 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-O 121.773 0.797 . . . . 0.0 110.092 -173.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.499 ' HB3' HD11 ' A' ' 4' ' ' ILE . 43.9 t0 -101.7 -23.67 14.2 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 114.622 -1.172 . . . . 0.0 109.959 -173.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.498 HD22 ' HG3' ' A' ' 96' ' ' GLN . 0.4 OUTLIER -108.55 160.33 27.58 Favored Pre-proline 0 C--N 1.324 -0.525 0 CA-C-N 114.639 -1.164 . . . . 0.0 110.058 179.718 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -60.13 -32.51 94.72 Favored 'Trans proline' 0 CA--C 1.532 0.391 0 C-N-CA 122.115 1.877 . . . . 0.0 112.826 -176.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.413 ' O ' HD13 ' A' ' 92' ' ' LEU . 23.1 t -153.68 141.7 13.91 Favored Pre-proline 0 C--N 1.321 -0.641 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 -177.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_endo -51.92 140.8 47.84 Favored 'Trans proline' 0 C--N 1.347 0.496 0 C-N-CA 123.011 2.474 . . . . 0.0 111.571 179.344 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.498 ' HG3' HD22 ' A' ' 92' ' ' LEU . 41.8 mt-30 -89.68 130.02 36.02 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 119.942 -0.703 . . . . 0.0 110.805 -175.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.554 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 52.3 mtmt -101.9 126.82 48.89 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.503 -0.771 . . . . 0.0 109.374 176.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.744 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 58.8 mmtt -123.3 141.94 51.46 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 116.001 -0.545 . . . . 0.0 109.94 178.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -99.7 142.79 30.7 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 115.595 -0.729 . . . . 0.0 109.899 -176.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.584 HG12 ' HH2' ' A' ' 77' ' ' TRP . 13.6 tt -134.87 137.56 50.61 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.152 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 22.9 t -157.97 149.84 21.84 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.108 -173.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.562 ' HE3' ' HE1' ' A' ' 13' ' ' PHE . 76.4 tttt . . . . . 0 C--O 1.247 0.973 0 CA-C-O 118.343 -0.837 . . . . 0.0 109.495 175.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 ppp? . . . . . 0 N--CA 1.481 1.121 0 CA-C-O 120.965 0.412 . . . . 0.0 111.214 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.606 ' HA3' ' HB2' ' A' ' 32' ' ' ALA . . . 166.21 -44.91 0.27 Allowed Glycine 0 N--CA 1.443 -0.836 0 N-CA-C 110.371 -1.092 . . . . 0.0 110.371 -179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 66.74 72.69 0.37 Allowed 'General case' 0 CA--C 1.519 -0.246 0 CA-C-O 121.598 0.713 . . . . 0.0 111.799 172.222 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.636 HG23 HD23 ' A' ' 31' ' ' LEU . 76.2 mt -64.64 122.93 16.45 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 CA-C-N 114.718 -1.128 . . . . 0.0 110.051 176.358 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 93.1 mt -109.48 130.58 55.49 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.121 0.486 . . . . 0.0 110.93 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 7.9 t -111.4 133.48 53.67 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.325 177.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -125.21 142.27 51.6 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.725 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.2 p -115.6 136.81 52.7 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.909 0.385 . . . . 0.0 111.129 179.17 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.491 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.5 mp -118.71 125.98 27.42 Favored Pre-proline 0 C--N 1.324 -0.542 0 CA-C-N 116.125 -0.488 . . . . 0.0 110.022 178.354 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -78.94 139.57 15.46 Favored 'Trans proline' 0 N--CA 1.459 -0.524 0 C-N-CA 122.786 2.324 . . . . 0.0 111.622 175.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.4 Cg_endo -69.96 149.77 66.05 Favored 'Trans proline' 0 C--O 1.234 0.303 0 C-N-CA 122.573 2.182 . . . . 0.0 111.81 178.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.467 ' O ' HG13 ' A' ' 16' ' ' ILE . 21.8 m -88.26 137.3 32.45 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 115.708 -0.678 . . . . 0.0 110.403 -177.326 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.55 ' HA ' HD12 ' A' ' 16' ' ' ILE . 75.6 t80 -54.18 -37.39 64.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 114.772 -1.103 . . . . 0.0 112.996 -169.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.38 -46.56 69.69 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.82 0.343 . . . . 0.0 110.653 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -62.95 -38.93 93.01 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.013 -0.54 . . . . 0.0 110.664 179.483 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.55 HD12 ' HA ' ' A' ' 13' ' ' PHE . 89.1 mt -58.26 -39.85 75.35 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.414 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.798 176.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 76.2 t80 -69.41 -44.6 71.09 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.805 -175.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.41 HD13 ' HA ' ' A' ' 18' ' ' LEU . 4.4 mm? -69.87 -44.6 69.47 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.635 -0.711 . . . . 0.0 111.331 -179.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.449 ' C ' ' H ' ' A' ' 21' ' ' SER . 16.2 m -70.8 -7.66 46.87 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.884 -178.277 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt 72.48 -18.8 0.32 Allowed 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.549 0.739 . . . . 0.0 111.517 179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.449 ' H ' ' C ' ' A' ' 19' ' ' SER . 57.4 m -138.72 162.35 34.9 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 109.492 -0.559 . . . . 0.0 109.492 176.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.563 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -99.19 159.32 15.07 Favored 'General case' 0 C--N 1.319 -0.736 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 176.518 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.469 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 8.1 p30 -128.08 134.54 49.17 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 121.237 0.542 . . . . 0.0 110.384 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.643 ' HB2' ' HB3' ' A' ' 70' ' ' ALA . 70.8 mt -88.35 126.04 35.0 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 177.73 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.491 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 62.7 m -111.0 112.32 24.06 Favored 'General case' 0 C--N 1.319 -0.745 0 CA-C-O 121.413 0.625 . . . . 0.0 111.065 -177.315 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.512 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 37.7 t -111.77 129.12 56.23 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.322 176.663 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -124.1 123.35 40.13 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 -178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 87' ' ' VAL . 12.0 t -118.15 119.95 62.95 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.59 0 C-N-CA 121.101 -0.24 . . . . 0.0 110.426 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 11.2 t -135.04 178.2 7.22 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.33 -174.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.3 m-20 58.8 41.86 20.88 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-O 121.345 0.593 . . . . 0.0 110.764 -176.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.636 HD23 HG23 ' A' ' 4' ' ' ILE . 43.4 mt -70.38 126.14 28.79 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.575 -0.739 . . . . 0.0 109.745 178.746 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.606 ' HB2' ' HA3' ' A' ' 2' ' ' GLY . . . -56.35 -31.21 63.55 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.373 -0.83 . . . . 0.0 112.352 -175.716 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.424 ' O ' ' HG3' ' A' ' 35' ' ' GLU . 70.9 p -125.98 -1.5 7.17 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 121.062 -0.255 . . . . 0.0 111.372 -178.717 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.474 ' HA ' ' HB2' ' A' ' 31' ' ' LEU . 80.5 m-85 52.51 -127.68 2.42 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.399 -171.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.424 ' HG3' ' O ' ' A' ' 33' ' ' THR . 47.7 mt-10 61.06 -144.84 0.46 Allowed 'General case' 0 C--O 1.235 0.317 0 CA-C-O 121.277 0.56 . . . . 0.0 111.933 176.329 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.973 HG23 ' HA ' ' A' ' 56' ' ' MET . 10.3 m -67.6 135.65 53.23 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.744 -176.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.768 HD23 ' HB3' ' A' ' 66' ' ' ALA . 47.5 tp -142.0 161.49 37.85 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.285 -0.416 . . . . 0.0 109.936 178.343 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 66.1 t30 -132.01 151.34 51.8 Favored 'General case' 0 C--N 1.32 -0.679 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 176.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.577 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.0 mm -121.08 140.29 45.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.599 0 N-CA-C 108.053 -1.092 . . . . 0.0 108.053 177.242 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.9 m -142.19 135.68 29.18 Favored 'General case' 0 C--N 1.323 -0.587 0 O-C-N 122.019 -0.426 . . . . 0.0 111.456 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.521 ' HD1' HG21 ' A' ' 51' ' ' THR . 67.6 m95 -119.21 149.88 41.0 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.888 177.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -157.45 144.67 18.46 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.192 175.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 44.9 t -65.09 163.17 15.4 Favored 'General case' 0 C--N 1.317 -0.836 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.351 172.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.41 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 31.1 tt0 -53.43 -31.6 46.02 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.228 0.537 . . . . 0.0 110.941 -179.815 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.8 t -72.87 -0.68 14.18 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.075 -178.733 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.51 17.77 67.82 Favored Glycine 0 N--CA 1.448 -0.542 0 C-N-CA 120.905 -0.664 . . . . 0.0 111.57 178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.477 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 52.5 mt-10 -93.99 127.86 43.52 Favored Pre-proline 0 C--N 1.325 -0.493 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -176.115 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.477 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 34.7 Cg_exo -57.97 136.32 74.36 Favored 'Trans proline' 0 C--O 1.235 0.349 0 C-N-CA 123.036 2.491 . . . . 0.0 112.911 -173.391 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.688 HD12 ' HB1' ' A' ' 70' ' ' ALA . 0.3 OUTLIER -97.69 146.84 24.94 Favored 'General case' 0 C--N 1.318 -0.786 0 CA-C-N 115.112 -0.949 . . . . 0.0 109.915 179.64 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.457 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 6.8 tp10 -67.31 104.67 1.55 Allowed 'General case' 0 N--CA 1.44 -0.947 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 174.292 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.791 HG22 HD11 ' A' ' 53' ' ' ILE . 1.7 m -145.79 128.51 16.23 Favored 'General case' 0 C--N 1.311 -1.072 0 CA-C-N 115.102 -0.954 . . . . 0.0 109.287 -177.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -123.19 120.09 32.14 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 120.003 -0.679 . . . . 0.0 110.694 176.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.791 HD11 HG22 ' A' ' 51' ' ' THR . 3.3 mp -136.83 128.8 43.68 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.447 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.277 178.582 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 15.7 tppt? -130.58 105.12 7.63 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 109.454 -0.573 . . . . 0.0 109.454 168.028 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.42 HG22 HG22 ' A' ' 53' ' ' ILE . 4.0 m -140.27 91.28 0.6 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 CA-C-O 121.64 0.733 . . . . 0.0 110.747 -179.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.973 ' HA ' HG23 ' A' ' 36' ' ' THR . 66.2 mtt -77.41 2.56 15.68 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.772 -0.649 . . . . 0.0 110.025 177.348 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -150.81 154.39 37.19 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.851 179.515 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' A' ' 64' ' ' PHE . 12.9 m -76.86 136.02 38.88 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 1.4 m-70 -93.58 130.17 36.09 Favored Pre-proline 0 C--N 1.326 -0.44 0 N-CA-C 112.902 0.705 . . . . 0.0 112.902 -167.206 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.488 ' HA ' ' O ' ' A' ' 63' ' ' THR . 1.0 OUTLIER -85.72 134.03 4.53 Favored 'Trans proline' 0 N--CA 1.453 -0.883 0 C-N-CA 123.551 2.834 . . . . 0.0 111.779 174.082 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -178.87 43.75 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -178.744 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 85.17 -4.93 84.73 Favored Glycine 0 N--CA 1.451 -0.348 0 N-CA-C 110.061 -1.216 . . . . 0.0 110.061 -170.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.488 ' O ' ' HA ' ' A' ' 60' ' ' PRO . 0.8 OUTLIER -141.4 169.3 17.86 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 178.451 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.448 ' O ' ' HB3' ' A' ' 58' ' ' SER . 65.0 m-85 -124.08 26.88 7.35 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 121.418 0.628 . . . . 0.0 110.054 -175.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.8 p -111.74 174.29 5.95 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.976 -164.956 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.768 ' HB3' HD23 ' A' ' 37' ' ' LEU . . . -106.84 148.2 28.82 Favored 'General case' 0 CA--C 1.518 -0.282 0 CA-C-N 115.191 -0.913 . . . . 0.0 108.92 171.085 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.458 ' HE2' HG23 ' A' ' 25' ' ' THR . 63.5 tttm -132.31 139.23 48.11 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 -175.368 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.577 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -128.97 133.98 7.81 Favored Glycine 0 N--CA 1.445 -0.722 0 C-N-CA 120.653 -0.784 . . . . 0.0 111.782 -179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 45.7 t -114.49 124.21 70.92 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 -178.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.688 ' HB1' HD12 ' A' ' 49' ' ' LEU . . . -114.85 155.98 25.78 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.4 179.112 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.6 m -108.41 121.35 44.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 120.673 0.273 . . . . 0.0 110.998 -172.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.563 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 4.2 m -128.34 153.35 37.67 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.211 0.529 . . . . 0.0 110.115 178.038 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 30.4 m -77.5 145.93 36.71 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.994 178.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.414 HG22 HG22 ' A' ' 16' ' ' ILE . 25.9 t -58.03 -33.57 46.72 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 CA-C-O 121.463 0.649 . . . . 0.0 109.663 178.274 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -57.63 -42.34 83.17 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 114.757 -1.11 . . . . 0.0 111.222 178.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -67.58 -41.35 84.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 N-CA-C 109.538 -0.541 . . . . 0.0 109.538 -178.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.684 ' CD1' ' HG2' ' A' ' 102' ' ' LYS . 0.7 OUTLIER -68.98 -35.14 76.38 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.617 -0.72 . . . . 0.0 110.185 179.468 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -69.62 -26.28 64.36 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.052 177.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -91.51 7.1 42.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.028 0.442 . . . . 0.0 110.004 176.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 43.3 ttp180 60.02 39.13 20.27 Favored 'General case' 0 CA--C 1.529 0.173 0 CA-C-N 115.223 -0.899 . . . . 0.0 111.582 178.974 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.561 ' HE2' ' HA ' ' A' ' 81' ' ' LYS . 3.2 mmpt? -56.67 147.45 22.62 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.962 174.344 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.455 ' HA ' ' O ' ' A' ' 100' ' ' ILE . 0.3 OUTLIER -115.0 139.33 49.94 Favored 'General case' 0 C--N 1.315 -0.934 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.882 178.042 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -125.5 158.09 35.36 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.524 -176.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 76.6 t -123.06 125.52 72.26 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.729 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.575 -177.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.666 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 30.8 p -105.76 135.44 47.17 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.478 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 96' ' ' GLN . 0.2 OUTLIER -125.31 136.29 53.33 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.767 -0.457 . . . . 0.0 109.767 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.57 HG11 HG11 ' A' ' 28' ' ' VAL . 28.8 t -110.57 127.72 67.4 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.636 0 CA-C-O 120.829 0.347 . . . . 0.0 111.154 -175.704 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.7 p -114.85 90.17 3.28 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.418 0.628 . . . . 0.0 111.409 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . . . . . . . . . 66.9 t60 -98.66 -15.41 19.43 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.667 177.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.414 ' HD2' ' HA ' ' A' ' 90' ' ' ARG . 0.1 OUTLIER 64.12 24.02 13.36 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.351 -0.84 . . . . 0.0 111.486 -178.548 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.0 t70 -98.91 -36.51 9.74 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.51 0.671 . . . . 0.0 109.462 174.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.479 HD13 ' O ' ' A' ' 94' ' ' SER . 0.4 OUTLIER -100.08 148.03 34.29 Favored Pre-proline 0 C--N 1.32 -0.687 0 CA-C-N 115.234 -0.894 . . . . 0.0 109.808 172.41 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -68.53 -22.48 38.45 Favored 'Trans proline' 0 C--O 1.233 0.229 0 C-N-CA 123.269 2.646 . . . . 0.0 112.884 -172.109 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.479 ' O ' HD13 ' A' ' 92' ' ' LEU . 14.3 m -132.88 130.07 21.4 Favored Pre-proline 0 C--N 1.319 -0.723 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 179.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.444 ' HD3' ' HA ' ' A' ' 94' ' ' SER . 24.5 Cg_exo -62.56 141.0 84.59 Favored 'Trans proline' 0 C--O 1.236 0.376 0 C-N-CA 122.464 2.109 . . . . 0.0 112.139 -178.645 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.458 ' O ' ' HA ' ' A' ' 86' ' ' THR . 3.4 pt20 -87.99 142.01 28.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.395 -178.58 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 20.1 ptmt -127.17 148.47 50.18 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-O 121.225 0.536 . . . . 0.0 111.209 -175.74 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.666 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 61.6 mmtt -134.15 145.6 49.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.611 177.612 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.48 ' CD1' HG22 ' A' ' 84' ' ' VAL . 34.3 m-85 -105.7 142.69 35.01 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.073 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.455 ' O ' ' HA ' ' A' ' 82' ' ' GLU . 9.7 tt -142.38 138.12 29.3 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.489 0 CA-C-O 120.766 0.317 . . . . 0.0 111.191 -179.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 23.3 p -158.34 148.66 20.14 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 174.775 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.684 ' HG2' ' CD1' ' A' ' 77' ' ' TRP . 0.3 OUTLIER . . . . . 0 C--O 1.253 1.262 0 CA-C-O 118.822 -0.609 . . . . 0.0 110.022 -178.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 ttp . . . . . 0 N--CA 1.478 0.926 0 CA-C-O 120.731 0.301 . . . . 0.0 110.468 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.18 152.42 22.17 Favored Glycine 0 N--CA 1.444 -0.774 0 C-N-CA 120.769 -0.729 . . . . 0.0 111.55 177.261 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -92.64 132.46 36.87 Favored 'General case' 0 C--N 1.318 -0.766 0 N-CA-C 109.927 -0.397 . . . . 0.0 109.927 179.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.611 HG12 ' HA ' ' A' ' 31' ' ' LEU . 64.5 mt -59.61 121.65 7.83 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 N-CA-C 109.892 -0.411 . . . . 0.0 109.892 178.51 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 97.4 mt -103.98 131.05 51.62 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.515 -176.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.475 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 11.6 p -117.5 122.17 42.97 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.427 179.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.1 m-85 -133.92 145.41 49.56 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.034 0.445 . . . . 0.0 110.406 179.032 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 17.8 p -115.41 135.91 53.63 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.317 179.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.2 mp -117.15 121.82 31.96 Favored Pre-proline 0 C--N 1.322 -0.59 0 N-CA-C 109.798 -0.445 . . . . 0.0 109.798 179.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.543 ' HA ' HD11 ' A' ' 100' ' ' ILE . 59.4 Cg_endo -70.44 140.01 39.15 Favored 'Trans proline' 0 N--CA 1.46 -0.481 0 C-N-CA 122.751 2.301 . . . . 0.0 111.654 177.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.479 ' HG2' HD11 ' A' ' 16' ' ' ILE . 66.1 Cg_endo -68.88 144.96 60.7 Favored 'Trans proline' 0 N--CA 1.456 -0.727 0 C-N-CA 122.26 1.973 . . . . 0.0 110.806 176.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -79.2 138.15 37.72 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -176.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 13.1 t80 -54.05 -42.59 69.41 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.72 0.295 . . . . 0.0 111.287 -170.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -64.4 -38.25 90.38 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.339 179.502 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -66.27 -35.9 81.58 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.059 0.457 . . . . 0.0 110.349 178.7 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.479 HD11 ' HG2' ' A' ' 11' ' ' PRO . 53.7 mt -67.36 -32.04 55.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-N 115.792 -0.64 . . . . 0.0 110.01 174.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 29.8 t80 -66.49 -36.94 83.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 115.927 -0.579 . . . . 0.0 109.652 177.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 19.0 mt -76.82 -48.01 19.77 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.389 -0.823 . . . . 0.0 111.006 -179.084 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 33.7 m -80.53 -10.35 59.74 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.209 -0.45 . . . . 0.0 111.408 -177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.472 ' HA ' ' HD3' ' A' ' 20' ' ' LYS . 63.2 mmtt 71.05 -57.09 0.61 Allowed 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.557 0.743 . . . . 0.0 111.739 -179.167 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.418 ' HB3' ' O ' ' A' ' 72' ' ' VAL . 20.0 m -95.08 127.17 40.93 Favored 'General case' 0 C--N 1.316 -0.862 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 176.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.541 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -60.97 145.53 50.21 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.777 -178.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.514 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 6.6 p30 -120.62 124.53 45.48 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-O 121.302 0.572 . . . . 0.0 110.558 -176.481 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.581 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 83.5 mt -83.36 130.52 35.06 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.807 -179.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 26.6 m -115.26 122.76 46.96 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.183 0.516 . . . . 0.0 111.139 -177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.409 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 44.9 t -111.27 138.47 47.7 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.45 -0.796 . . . . 0.0 110.723 -178.681 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -126.19 122.45 35.67 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 109.385 -0.598 . . . . 0.0 109.385 176.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 26.8 t -127.86 120.83 54.97 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.401 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 178.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 17.6 t -137.43 177.08 8.14 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 116.615 -0.266 . . . . 0.0 110.5 -173.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 58.6 35.8 24.74 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.116 0.566 . . . . 0.0 112.048 179.763 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.676 ' HB2' ' HA ' ' A' ' 34' ' ' TYR . 48.9 mt -60.07 124.95 21.82 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 177.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -57.39 -25.87 60.19 Favored 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 112.601 0.593 . . . . 0.0 112.601 -170.316 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.515 HG23 ' HB2' ' A' ' 35' ' ' GLU . 12.7 t -129.86 7.55 5.18 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-O 120.633 0.254 . . . . 0.0 110.86 177.646 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.676 ' HA ' ' HB2' ' A' ' 31' ' ' LEU . 48.9 m-85 56.51 -87.36 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.835 -0.62 . . . . 0.0 110.77 -171.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.863 ' HG3' ' H ' ' A' ' 36' ' ' THR . 6.8 tp10 55.02 -154.23 0.3 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.027 0.441 . . . . 0.0 111.467 170.514 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.863 ' H ' ' HG3' ' A' ' 35' ' ' GLU . 8.1 t -85.69 163.63 18.13 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 173.553 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.533 ' HB3' ' OG ' ' A' ' 58' ' ' SER . 66.4 tp -160.08 151.26 19.37 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-O 121.062 0.458 . . . . 0.0 109.948 179.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -119.51 152.66 36.59 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.827 -0.805 . . . . 0.0 108.827 177.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.617 HG21 ' HA3' ' A' ' 68' ' ' GLY . 22.3 mm -120.43 135.82 59.46 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 N-CA-C 108.057 -1.09 . . . . 0.0 108.057 174.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.3 m -139.27 125.84 20.54 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 121.077 0.465 . . . . 0.0 111.531 -176.493 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.546 ' CZ3' ' HB2' ' A' ' 85' ' ' CYS . 85.8 m95 -106.81 148.2 28.79 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.122 174.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -154.0 156.13 36.83 Favored 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.44 -0.578 . . . . 0.0 109.44 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . 0.747 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 22.8 m -87.84 156.8 19.21 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 109.624 -0.509 . . . . 0.0 109.624 176.146 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 27.3 tt0 -60.24 -19.98 56.9 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 120.965 0.412 . . . . 0.0 111.149 -177.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 1.7 p -72.76 -7.35 50.18 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.211 176.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.8 18.24 41.44 Favored Glycine 0 N--CA 1.448 -0.546 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.041 176.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.747 ' HG2' ' HB2' ' A' ' 43' ' ' SER . 13.2 pt-20 -101.81 133.9 20.48 Favored Pre-proline 0 C--N 1.323 -0.55 0 CA-C-O 120.507 0.194 . . . . 0.0 110.745 -177.222 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.494 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 12.1 Cg_exo -69.78 136.79 33.81 Favored 'Trans proline' 0 C--N 1.343 0.25 0 C-N-CA 122.676 2.251 . . . . 0.0 112.416 -178.822 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD23 ' HA ' ' A' ' 49' ' ' LEU . 9.0 mt -106.08 142.02 36.48 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.62 177.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -64.57 106.72 1.21 Allowed 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.938 -178.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 12.2 m -104.89 116.78 32.56 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.369 -0.832 . . . . 0.0 109.804 178.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -93.99 120.8 34.74 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.528 0.68 . . . . 0.0 110.447 -178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.56 HD11 ' HB ' ' A' ' 39' ' ' ILE . 41.8 mt -134.44 138.87 49.03 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.463 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.923 -176.153 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.51 ' HD2' ' C ' ' A' ' 53' ' ' ILE . 3.6 mptp? -121.95 147.07 46.5 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 173.248 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.49 HG12 ' H ' ' A' ' 57' ' ' GLU . 57.9 t 75.55 116.43 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.466 0.342 0 O-C-N 123.98 0.8 . . . . 0.0 109.898 -174.004 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 93.2 mmm -79.22 8.84 5.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.357 -172.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.49 ' H ' HG12 ' A' ' 55' ' ' VAL . 13.4 pt-20 -130.53 153.33 48.95 Favored 'General case' 0 C--N 1.318 -0.762 0 N-CA-C 110.074 -0.343 . . . . 0.0 110.074 179.377 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.533 ' OG ' ' HB3' ' A' ' 37' ' ' LEU . 28.8 m -82.1 162.36 22.54 Favored 'General case' 0 C--N 1.325 -0.5 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 175.379 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.691 ' HB2' ' HB ' ' A' ' 63' ' ' THR . 96.2 m-70 -100.77 126.96 33.65 Favored Pre-proline 0 C--N 1.32 -0.698 0 C-N-CA 119.575 -0.85 . . . . 0.0 110.989 -174.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . . . . . . . . . 83.6 Cg_endo -103.29 -0.95 0.32 Allowed 'Trans proline' 0 N--CA 1.452 -0.951 0 C-N-CA 123.834 3.023 . . . . 0.0 112.045 170.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.443 ' C ' ' H ' ' A' ' 63' ' ' THR . 45.1 t-20 -142.37 128.14 19.3 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 109.157 -0.682 . . . . 0.0 109.157 -174.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 80.79 -30.74 2.55 Favored Glycine 0 CA--C 1.517 0.209 0 N-CA-C 111.31 -0.716 . . . . 0.0 111.31 -174.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.691 ' HB ' ' HB2' ' A' ' 59' ' ' HIS . 7.1 m -144.28 158.1 43.92 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 106.714 -1.587 . . . . 0.0 106.714 173.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -121.21 23.62 10.42 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 118.407 0.549 . . . . 0.0 110.971 -177.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 19.5 p -156.18 172.74 17.93 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 121.659 0.742 . . . . 0.0 112.885 -170.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.428 ' HB2' ' OG ' ' A' ' 58' ' ' SER . . . -108.71 148.34 30.61 Favored 'General case' 0 CA--C 1.516 -0.347 0 CA-C-N 114.49 -1.232 . . . . 0.0 108.112 167.298 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp -131.48 140.64 49.6 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.828 -0.434 . . . . 0.0 109.828 -177.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.617 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -136.69 127.49 4.11 Favored Glycine 0 N--CA 1.445 -0.75 0 C-N-CA 120.874 -0.679 . . . . 0.0 111.608 179.264 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.581 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 43.3 t -115.08 128.29 72.31 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.49 0 CA-C-O 120.759 0.314 . . . . 0.0 110.596 -177.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.514 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -116.53 148.64 40.65 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.69 179.434 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.0 m -99.93 124.1 44.89 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-N 116.501 -0.318 . . . . 0.0 110.266 178.699 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.541 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 3.6 m -119.73 166.96 13.62 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.418 0 N-CA-C 110.085 -0.339 . . . . 0.0 110.085 179.338 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.471 ' HB3' ' OD2' ' A' ' 76' ' ' ASP . 23.2 t -86.68 154.29 21.1 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.193 -178.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 15.5 t -62.37 -39.66 85.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.394 0 CA-C-O 121.076 0.465 . . . . 0.0 110.67 -176.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -58.36 -36.24 73.18 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 115.523 -0.762 . . . . 0.0 111.789 -178.159 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 73' ' ' SER . 13.3 m-20 -63.94 -45.02 91.06 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.335 0.588 . . . . 0.0 110.094 -179.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.457 ' HE1' ' HD2' ' A' ' 102' ' ' LYS . 0.2 OUTLIER -72.5 -35.07 68.05 Favored 'General case' 0 C--N 1.322 -0.605 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.196 -179.179 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 11.1 m-20 -65.76 -30.22 70.84 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.235 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.401 ' HB2' ' HG2' ' A' ' 81' ' ' LYS . 95.3 m-20 -90.85 7.27 40.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.464 -0.335 . . . . 0.0 111.096 179.727 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 24.7 mmt180 57.89 36.77 26.6 Favored 'General case' 0 N--CA 1.466 0.346 0 O-C-N 123.387 0.43 . . . . 0.0 110.912 -179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.401 ' HG2' ' HB2' ' A' ' 79' ' ' ASN . 31.6 mmmt -68.93 163.31 24.75 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.982 -0.554 . . . . 0.0 111.336 -177.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.428 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 51.3 mt-10 -114.69 139.75 49.41 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.584 -0.734 . . . . 0.0 110.507 179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.419 ' O ' ' HA ' ' A' ' 99' ' ' PHE . 75.1 m-85 -121.14 157.29 30.47 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.792 177.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.522 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 93.5 t -120.75 129.0 76.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.614 0 CA-C-O 121.081 0.467 . . . . 0.0 110.967 -176.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.546 ' HB2' ' CZ3' ' A' ' 41' ' ' TRP . 34.9 t -106.18 127.62 53.34 Favored 'General case' 0 C--N 1.314 -0.955 0 N-CA-C 109.048 -0.723 . . . . 0.0 109.048 173.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -117.12 126.16 52.38 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 179.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.466 ' CG1' HD11 ' A' ' 37' ' ' LEU . 54.1 t -105.9 125.67 61.37 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.795 0 CA-C-O 121.143 0.497 . . . . 0.0 111.1 -177.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.1 p -120.56 103.9 9.53 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.501 179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.731 ' ND1' ' HB2' ' A' ' 91' ' ' ASP . 39.6 t-80 -98.39 -20.37 17.19 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.048 -176.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.509 ' O ' ' HG2' ' A' ' 90' ' ' ARG . 18.9 ttt180 74.04 8.13 4.75 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-O 122.008 0.908 . . . . 0.0 108.786 -169.801 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.731 ' HB2' ' ND1' ' A' ' 89' ' ' HIS . 11.2 t0 -93.58 -36.41 12.4 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 114.846 -1.07 . . . . 0.0 109.773 -176.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.419 ' O ' HD12 ' A' ' 92' ' ' LEU . 0.7 OUTLIER -119.32 151.96 51.88 Favored Pre-proline 0 C--N 1.325 -0.487 0 CA-C-N 114.972 -1.013 . . . . 0.0 110.319 178.501 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -72.58 -31.33 11.05 Favored 'Trans proline' 0 C--O 1.234 0.28 0 C-N-CA 123.017 2.478 . . . . 0.0 112.801 -174.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 14.3 m -116.77 111.54 41.17 Favored Pre-proline 0 C--N 1.32 -0.705 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.168 -176.802 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -62.91 141.25 83.63 Favored 'Trans proline' 0 N--CA 1.459 -0.544 0 C-N-CA 122.257 1.971 . . . . 0.0 111.939 -179.296 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -86.43 127.4 34.83 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.467 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -112.76 128.31 56.39 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.305 178.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.522 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 64.5 mmtt -122.77 149.32 44.27 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.52 -0.764 . . . . 0.0 111.023 -174.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . 0.419 ' HA ' ' O ' ' A' ' 83' ' ' PHE . 97.4 m-85 -105.73 146.79 29.34 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.966 -179.792 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.543 HD11 ' HA ' ' A' ' 10' ' ' PRO . 13.8 tt -136.34 138.75 46.5 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.679 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.265 175.324 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.428 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 10.7 t -158.85 149.92 20.3 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.92 -0.582 . . . . 0.0 109.523 177.726 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.821 ' HA ' ' HE2' ' A' ' 102' ' ' LYS . 0.6 OUTLIER . . . . . 0 C--O 1.248 0.999 0 CA-C-O 118.558 -0.735 . . . . 0.0 110.321 -179.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 43.5 ttm . . . . . 0 N--CA 1.48 1.068 0 CA-C-O 120.854 0.359 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 157.06 -86.75 0.12 Allowed Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.715 -0.755 . . . . 0.0 111.974 -179.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -78.69 118.45 20.79 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.592 HG12 ' HA ' ' A' ' 31' ' ' LEU . 77.1 mt -70.7 123.12 24.0 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.534 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.264 -178.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 75.1 mt -104.95 131.03 52.98 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.009 0.433 . . . . 0.0 110.345 -177.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.415 ' O ' ' HE3' ' A' ' 98' ' ' LYS . 13.9 p -109.42 123.48 49.42 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.817 -0.628 . . . . 0.0 110.843 -179.067 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 87.0 m-85 -119.32 131.39 55.72 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.047 0.451 . . . . 0.0 110.396 179.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.407 ' HB ' HD12 ' A' ' 100' ' ' ILE . 3.2 p -119.51 131.57 55.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.369 176.273 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . 0.409 ' HB ' ' HB ' ' A' ' 25' ' ' THR . 4.3 mp -117.88 124.48 28.75 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-O 120.975 0.417 . . . . 0.0 110.495 -178.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -75.41 140.73 24.69 Favored 'Trans proline' 0 N--CA 1.46 -0.477 0 C-N-CA 122.886 2.391 . . . . 0.0 111.507 175.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.551 ' HD2' ' CZ2' ' A' ' 77' ' ' TRP . 51.8 Cg_endo -64.85 147.41 89.44 Favored 'Trans proline' 0 N--CA 1.462 -0.34 0 C-N-CA 122.578 2.185 . . . . 0.0 111.845 179.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.403 ' O ' HG13 ' A' ' 16' ' ' ILE . 10.7 p -89.56 146.44 24.58 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.136 -177.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . 0.83 ' HE1' ' HE2' ' A' ' 102' ' ' LYS . 47.9 m-85 -59.76 -31.39 69.61 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.096 -0.957 . . . . 0.0 111.446 -174.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.23 -42.15 76.06 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.563 177.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -73.02 -35.07 66.72 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.404 -0.362 . . . . 0.0 110.502 -177.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.403 HG13 ' O ' ' A' ' 12' ' ' SER . 83.1 mt -63.46 -32.02 55.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.216 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.461 176.11 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 79.6 t80 -62.99 -43.93 97.43 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.405 177.813 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -73.98 -47.87 34.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.585 -0.734 . . . . 0.0 111.422 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 44.6 m -70.69 -24.24 62.63 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.972 -177.188 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 52.4 mtpt 70.94 -6.07 1.36 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.496 0.718 . . . . 0.0 111.368 -177.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 71.3 p -137.9 161.99 35.2 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -92.74 136.73 32.98 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 177.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -125.88 130.26 50.98 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-O 120.986 0.422 . . . . 0.0 110.057 -177.562 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.439 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 88.6 mt -86.29 128.91 34.99 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.45 -176.574 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . 0.409 ' HB ' ' HB ' ' A' ' 9' ' ' ILE . 18.2 m -109.05 114.4 28.1 Favored 'General case' 0 C--N 1.32 -0.68 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.504 -178.92 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.597 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 25.3 t -114.05 134.82 54.61 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.117 -179.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.408 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 1.0 OUTLIER -135.97 129.11 31.63 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 121.142 0.496 . . . . 0.0 110.109 175.977 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.633 ' HB ' HD21 ' A' ' 37' ' ' LEU . 15.4 t -123.35 132.87 70.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 -178.26 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 8.9 t -143.3 171.84 13.56 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-O 121.156 0.503 . . . . 0.0 111.557 -173.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 64.51 48.95 2.53 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-N 114.517 -1.219 . . . . 0.0 110.173 169.821 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.592 ' HA ' HG12 ' A' ' 4' ' ' ILE . 0.5 OUTLIER -72.79 157.17 38.0 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-N 114.098 -1.41 . . . . 0.0 109.122 178.754 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -63.97 -49.89 70.75 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 120.881 0.372 . . . . 0.0 110.926 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.5 t -158.58 151.08 21.88 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.351 179.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.9 m-85 65.64 91.97 0.08 Allowed 'General case' 0 C--O 1.234 0.277 0 O-C-N 124.029 0.83 . . . . 0.0 111.274 176.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 58' ' ' SER . 37.7 mp0 -75.8 58.98 1.17 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.425 0.631 . . . . 0.0 111.089 179.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.532 HG23 ' HG2' ' A' ' 57' ' ' GLU . 11.3 m -93.62 -68.22 0.81 Allowed 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 171.625 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.633 HD21 ' HB ' ' A' ' 28' ' ' VAL . 18.8 tp 63.21 171.45 0.15 Allowed 'General case' 0 CA--C 1.537 0.45 0 CA-C-N 115.382 -0.826 . . . . 0.0 112.57 170.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.404 ' N ' ' HG ' ' A' ' 37' ' ' LEU . 4.9 t-20 -143.49 151.05 39.84 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.307 -0.86 . . . . 0.0 108.911 176.735 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.729 HG21 ' HA3' ' A' ' 68' ' ' GLY . 17.5 mm -121.14 136.05 59.35 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.493 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 177.842 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 39.2 t -145.67 128.58 16.42 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 120.896 0.379 . . . . 0.0 110.863 -179.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.597 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 55.2 m95 -108.7 149.03 29.56 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.474 176.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.55 163.81 38.86 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.622 176.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 23.1 t -84.68 168.69 15.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.412 ' HB2' ' O ' ' A' ' 82' ' ' GLU . 56.4 tt0 -57.37 -29.18 63.84 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-O 121.086 0.47 . . . . 0.0 110.85 -179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 4.7 p -73.66 -4.3 33.49 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.526 179.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 86.1 20.79 54.52 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.976 -0.63 . . . . 0.0 111.812 179.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 39.8 mt-10 -99.64 123.6 47.29 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 110.07 -0.344 . . . . 0.0 110.07 -177.789 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 32.2 Cg_exo -58.66 137.55 80.78 Favored 'Trans proline' 0 C--N 1.344 0.322 0 C-N-CA 123.154 2.569 . . . . 0.0 113.217 -173.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 12.4 mt -106.34 148.35 28.14 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.227 -0.897 . . . . 0.0 110.664 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.514 ' O ' ' HA ' ' A' ' 70' ' ' ALA . 39.4 mm-40 -62.71 106.59 0.82 Allowed 'General case' 0 N--CA 1.449 -0.514 0 CA-C-N 115.901 -0.59 . . . . 0.0 110.808 179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.595 HG22 HD11 ' A' ' 53' ' ' ILE . 3.1 m -117.68 113.88 22.54 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 115.397 -0.819 . . . . 0.0 109.874 -177.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 20.6 pttp -105.01 120.92 42.65 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.125 0.488 . . . . 0.0 110.957 -177.586 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.595 HD11 HG22 ' A' ' 51' ' ' THR . 4.1 mp -134.4 127.33 50.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.665 178.442 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.5 mmtp -97.7 146.92 24.88 Favored 'General case' 0 C--N 1.321 -0.667 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 171.389 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.641 HG12 ' H ' ' A' ' 57' ' ' GLU . 42.2 t 75.68 120.76 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.463 0.224 0 O-C-N 124.043 0.839 . . . . 0.0 109.437 -169.771 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . . . . . . . . . 64.7 mtt -84.89 8.39 17.64 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.921 -175.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.641 ' H ' HG12 ' A' ' 55' ' ' VAL . 48.1 mt-10 -127.24 156.66 41.53 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 115.467 -0.788 . . . . 0.0 109.801 -177.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . 0.499 ' HB2' ' HB3' ' A' ' 35' ' ' GLU . 18.2 m -76.86 154.75 33.5 Favored 'General case' 0 C--N 1.322 -0.594 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 -178.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.442 ' HA ' ' HD3' ' A' ' 60' ' ' PRO . 33.3 m170 -93.33 128.91 40.78 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.492 -171.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.442 ' HD3' ' HA ' ' A' ' 59' ' ' HIS . 96.2 Cg_endo -97.3 30.95 0.15 Allowed 'Trans proline' 0 N--CA 1.45 -1.081 0 C-N-CA 123.263 2.642 . . . . 0.0 112.631 178.35 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -104.01 106.95 17.62 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.088 -0.506 . . . . 0.0 110.176 -178.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 83.67 -49.69 4.27 Favored Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.859 -0.686 . . . . 0.0 111.451 -178.443 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.454 HG22 ' H ' ' A' ' 64' ' ' PHE . 1.6 m -137.08 169.43 17.8 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 176.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.454 ' H ' HG22 ' A' ' 63' ' ' THR . 91.1 m-85 -98.95 29.92 3.61 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 122.931 0.493 . . . . 0.0 111.41 -175.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -107.58 163.62 12.91 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.669 0.747 . . . . 0.0 112.859 -165.086 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.432 ' HB3' HD11 ' A' ' 39' ' ' ILE . . . -109.54 158.51 17.94 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-N 114.991 -1.004 . . . . 0.0 109.287 175.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -134.23 140.43 46.47 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-O 120.747 0.308 . . . . 0.0 110.462 -176.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.729 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -139.43 138.69 9.45 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 111.557 -0.617 . . . . 0.0 111.557 176.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.439 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 61.6 t -123.2 129.0 75.18 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.518 0 CA-C-O 120.802 0.334 . . . . 0.0 110.78 -176.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.514 ' HA ' ' O ' ' A' ' 50' ' ' GLU . . . -116.61 150.49 37.99 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.406 178.66 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 16.4 m -102.63 119.85 39.54 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 110.068 -0.345 . . . . 0.0 110.068 178.365 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . . . . . . . . . 2.8 m -127.19 166.4 23.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-O 120.977 0.418 . . . . 0.0 110.779 -176.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.566 ' HB2' ' OD1' ' A' ' 76' ' ' ASP . 14.8 m -85.16 137.62 32.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.271 -178.368 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.7 t -65.67 -24.98 35.5 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.436 -176.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -67.2 -33.95 76.47 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.495 -0.775 . . . . 0.0 111.034 176.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.566 ' OD1' ' HB2' ' A' ' 73' ' ' SER . 3.5 m-20 -66.11 -41.32 90.71 Favored 'General case' 0 CA--C 1.516 -0.347 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 177.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.551 ' CZ2' ' HD2' ' A' ' 11' ' ' PRO . 0.1 OUTLIER -65.86 -41.33 91.79 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 114.911 -1.04 . . . . 0.0 110.072 177.455 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -67.28 -30.07 69.84 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.374 -0.83 . . . . 0.0 111.995 -179.173 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 84.0 m-20 -91.38 8.01 38.28 Favored 'General case' 0 C--N 1.329 -0.321 0 C-N-CA 121.214 -0.195 . . . . 0.0 111.061 -178.532 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER 59.97 37.26 21.48 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-N 116.101 -0.5 . . . . 0.0 111.467 -178.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt -67.2 161.83 23.89 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.05 0.453 . . . . 0.0 110.146 176.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.412 ' O ' ' HB2' ' A' ' 44' ' ' GLN . 45.8 mt-10 -112.65 140.53 47.34 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.445 179.335 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.42 ' HD2' ' HZ3' ' A' ' 77' ' ' TRP . 74.9 m-85 -121.32 149.69 42.55 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.482 176.081 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.524 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 90.2 t -123.01 120.33 60.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.723 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.083 -173.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.663 ' SG ' ' HB2' ' A' ' 98' ' ' LYS . 29.7 p -105.67 135.32 47.3 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 174.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.442 HG22 ' HB2' ' A' ' 95' ' ' PRO . 1.2 m -122.38 132.94 54.62 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-O 120.775 0.322 . . . . 0.0 110.156 -177.366 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.466 HG11 HG11 ' A' ' 28' ' ' VAL . 44.3 t -109.1 126.99 66.13 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.766 -178.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -117.8 88.5 2.93 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.59 0.709 . . . . 0.0 111.58 -178.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.526 ' O ' ' HG3' ' A' ' 90' ' ' ARG . 23.5 t60 -98.82 -6.89 28.33 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.514 179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.526 ' HG3' ' O ' ' A' ' 89' ' ' HIS . 0.1 OUTLIER 52.29 24.09 2.7 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.629 1.172 . . . . 0.0 111.901 -175.169 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.411 ' HB2' ' CD2' ' A' ' 89' ' ' HIS . 29.0 t70 -94.05 -28.51 15.69 Favored 'General case' 0 C--N 1.305 -1.34 0 CA-C-N 114.468 -1.242 . . . . 0.0 109.562 -179.22 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.498 HD13 ' O ' ' A' ' 94' ' ' SER . 0.3 OUTLIER -118.23 156.07 51.01 Favored Pre-proline 0 C--N 1.32 -0.676 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.049 -179.731 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 45.9 Cg_endo -68.52 -21.86 39.4 Favored 'Trans proline' 0 C--N 1.346 0.4 0 C-N-CA 123.056 2.504 . . . . 0.0 113.106 -175.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.498 ' O ' HD13 ' A' ' 92' ' ' LEU . 37.5 p -134.63 125.0 17.28 Favored Pre-proline 0 C--N 1.323 -0.585 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.499 178.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.442 ' HB2' HG22 ' A' ' 86' ' ' THR . 18.0 Cg_endo -61.35 141.38 92.38 Favored 'Trans proline' 0 C--N 1.345 0.363 0 C-N-CA 122.585 2.19 . . . . 0.0 111.412 177.51 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.435 ' O ' ' HA ' ' A' ' 86' ' ' THR . 33.2 mt-30 -80.58 126.73 31.62 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 120.964 0.411 . . . . 0.0 111.148 -178.697 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -107.36 126.71 52.81 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.366 -0.834 . . . . 0.0 109.368 177.184 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.663 ' HB2' ' SG ' ' A' ' 85' ' ' CYS . 16.7 mmtt -115.27 133.78 55.73 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.382 -0.372 . . . . 0.0 110.967 -178.292 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -101.21 122.75 44.2 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.727 -0.669 . . . . 0.0 109.799 178.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.407 HD12 ' HB ' ' A' ' 8' ' ' THR . 12.5 tt -122.17 139.89 47.76 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.689 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.159 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 12.1 t -157.28 150.01 23.28 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.388 -0.369 . . . . 0.0 110.047 -179.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.83 ' HE2' ' HE1' ' A' ' 13' ' ' PHE . 47.7 tttm . . . . . 0 C--O 1.249 1.039 0 CA-C-O 118.71 -0.662 . . . . 0.0 110.813 179.311 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 52.1 ttp . . . . . 0 N--CA 1.48 1.052 0 CA-C-O 120.845 0.355 . . . . 0.0 110.453 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.929 ' HA2' ' HB2' ' A' ' 32' ' ' ALA . . . -96.48 48.61 1.69 Allowed Glycine 0 N--CA 1.446 -0.667 0 C-N-CA 120.689 -0.767 . . . . 0.0 111.672 -176.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -87.28 74.99 9.38 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-O 120.857 0.361 . . . . 0.0 110.561 -173.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.6 HG23 HD23 ' A' ' 31' ' ' LEU . 73.5 mt -60.4 121.49 8.34 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.719 0 CA-C-N 115.652 -0.703 . . . . 0.0 110.228 177.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 71.7 mt -107.31 138.32 43.72 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.674 -0.694 . . . . 0.0 111.257 -176.133 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.565 HG22 HG22 ' A' ' 28' ' ' VAL . 2.2 p -115.05 120.07 38.58 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.811 -0.631 . . . . 0.0 111.858 179.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -119.36 132.01 55.78 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.504 178.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 11.7 p -115.63 132.48 56.62 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.258 176.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 4.4 mp -117.96 125.92 27.64 Favored Pre-proline 0 C--N 1.324 -0.523 0 CA-C-O 120.81 0.338 . . . . 0.0 110.427 -177.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . 0.47 ' HA ' HD11 ' A' ' 100' ' ' ILE . 55.9 Cg_endo -70.75 139.59 37.1 Favored 'Trans proline' 0 N--CA 1.462 -0.351 0 C-N-CA 122.612 2.208 . . . . 0.0 111.444 175.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.499 ' HG2' HD11 ' A' ' 16' ' ' ILE . 55.7 Cg_endo -68.81 154.96 70.18 Favored 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.736 2.29 . . . . 0.0 112.447 -179.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.438 ' O ' HG13 ' A' ' 16' ' ' ILE . 11.9 p -84.82 126.09 33.15 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.436 -177.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PHE . . . . . . . . . . . . . 57.2 t80 -61.4 -30.83 70.8 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.839 -0.618 . . . . 0.0 111.554 -174.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.486 ' O ' ' HG ' ' A' ' 18' ' ' LEU . . . -62.18 -40.28 95.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.047 0.451 . . . . 0.0 110.625 177.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -74.04 -43.14 58.92 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.903 177.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.499 HD11 ' HG2' ' A' ' 11' ' ' PRO . 76.5 mt -57.69 -32.69 43.14 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.159 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.469 177.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 26.0 t80 -63.08 -39.0 93.41 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.43 178.51 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.486 ' HG ' ' O ' ' A' ' 14' ' ' ALA . 41.1 mt -72.6 -48.14 42.16 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.557 -173.27 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 37.8 p -86.46 -18.16 32.39 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.865 0.364 . . . . 0.0 111.381 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 27.4 mtmm 68.87 16.12 8.87 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 123.734 0.813 . . . . 0.0 110.117 -174.738 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 19.8 m -135.35 128.88 32.53 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.886 -0.597 . . . . 0.0 110.314 -176.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.416 ' HB3' ' CG2' ' A' ' 72' ' ' VAL . . . -87.14 136.61 32.86 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.613 176.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.472 ' HA ' ' O ' ' A' ' 70' ' ' ALA . 48.8 m-80 -122.93 125.9 46.21 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 121.091 0.472 . . . . 0.0 110.147 -178.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.472 ' O ' ' HA ' ' A' ' 69' ' ' VAL . 70.9 mt -83.46 131.08 35.04 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.003 -178.068 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 34.2 m -119.07 121.19 39.27 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-O 121.286 0.565 . . . . 0.0 110.949 -177.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' CYS . . . . . 0.584 ' HB2' ' CZ2' ' A' ' 41' ' ' TRP . 39.4 t -126.88 137.97 53.24 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-N 115.405 -0.816 . . . . 0.0 110.171 178.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.427 ' HA ' ' O ' ' A' ' 66' ' ' ALA . 3.9 tt -133.5 132.9 41.54 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.009 177.17 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 87' ' ' VAL . 43.6 t -115.12 118.52 59.05 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.587 0 CA-C-N 116.024 -0.535 . . . . 0.0 109.864 -178.101 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 21.9 p -121.2 178.57 4.71 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.869 -169.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 6.0 m-20 59.17 35.88 23.76 Favored 'General case' 0 N--CA 1.466 0.326 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.464 176.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.6 HD23 HG23 ' A' ' 4' ' ' ILE . 9.7 mt -71.79 123.64 23.08 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 176.272 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . 0.929 ' HB2' ' HA2' ' A' ' 2' ' ' GLY . . . -60.93 -49.81 75.93 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.143 0.496 . . . . 0.0 110.922 -178.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 5.6 t -126.88 134.7 50.43 Favored 'General case' 0 C--N 1.319 -0.739 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 170.429 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -123.56 142.96 50.51 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-O 121.322 0.582 . . . . 0.0 111.703 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 18.8 tt0 -155.43 -85.98 0.05 Allowed 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 114.76 -1.109 . . . . 0.0 108.859 178.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . 0.571 HG22 ' HA ' ' A' ' 56' ' ' MET . 7.4 p -108.92 89.93 3.14 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.5 179.185 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.565 HD21 ' HB ' ' A' ' 28' ' ' VAL . 48.1 tp -95.3 147.86 23.04 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 175.814 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.405 ' H ' HD12 ' A' ' 37' ' ' LEU . 9.9 t30 -133.4 146.18 50.99 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.385 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ILE . . . . . 0.509 HG21 ' HA3' ' A' ' 68' ' ' GLY . 25.2 mm -120.08 134.41 63.68 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 108.682 -0.859 . . . . 0.0 108.682 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 60.2 m -129.32 133.84 47.63 Favored 'General case' 0 C--N 1.321 -0.658 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.041 179.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TRP . . . . . 0.584 ' CZ2' ' HB2' ' A' ' 26' ' ' CYS . 79.6 m95 -111.77 146.59 37.33 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.23 174.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -153.07 164.39 38.1 Favored 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.927 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.4 t -73.8 167.17 21.96 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 173.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.493 ' HA ' HG23 ' A' ' 84' ' ' VAL . 35.9 tt0 -59.78 -31.22 69.48 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.008 0.432 . . . . 0.0 110.841 -177.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.427 ' HB2' ' HG2' ' A' ' 47' ' ' GLU . 18.4 m -75.11 -6.81 51.52 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.435 179.06 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.35 19.69 37.77 Favored Glycine 0 N--CA 1.449 -0.462 0 C-N-CA 120.979 -0.629 . . . . 0.0 112.295 -178.254 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.453 ' HA ' ' HD3' ' A' ' 48' ' ' PRO . 6.6 mm-40 -81.77 122.42 80.25 Favored Pre-proline 0 C--N 1.326 -0.456 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 178.844 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' PRO . . . . . 0.453 ' HD3' ' HA ' ' A' ' 47' ' ' GLU . 23.3 Cg_exo -62.38 135.8 55.85 Favored 'Trans proline' 0 C--O 1.235 0.372 0 C-N-CA 122.546 2.164 . . . . 0.0 113.352 -172.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.411 ' HA ' HD23 ' A' ' 49' ' ' LEU . 7.6 mt -105.91 148.36 27.71 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.217 177.353 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.65 106.33 2.17 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.419 179.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' THR . . . . . 0.428 HG22 HD11 ' A' ' 53' ' ' ILE . 18.1 m -144.06 114.32 7.45 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.824 -178.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -115.99 120.15 38.2 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 120.34 -0.544 . . . . 0.0 111.116 -173.783 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.428 HD11 HG22 ' A' ' 51' ' ' THR . 5.2 mp -135.35 119.72 26.66 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.575 0 CA-C-N 115.506 -0.77 . . . . 0.0 109.061 174.447 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -128.18 105.3 8.27 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.596 -0.442 . . . . 0.0 109.936 176.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -156.76 147.91 11.23 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.492 0 CA-C-N 115.572 -0.74 . . . . 0.0 110.357 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' MET . . . . . 0.571 ' HA ' HG22 ' A' ' 36' ' ' THR . 0.0 OUTLIER -107.27 8.38 29.83 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.881 -0.785 . . . . 0.0 108.881 171.944 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -131.57 151.19 51.8 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 114.562 -1.199 . . . . 0.0 109.739 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 22.3 m -81.54 165.25 21.33 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 174.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.535 ' HB2' ' O ' ' A' ' 65' ' ' SER . 10.5 m-70 -91.33 133.72 30.98 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 120.89 0.376 . . . . 0.0 111.065 -172.416 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' PRO . . . . . 0.463 ' HB2' ' H ' ' A' ' 61' ' ' ASN . 94.6 Cg_endo -93.07 -145.43 0.02 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.808 0 C-N-CA 123.596 2.864 . . . . 0.0 112.493 178.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.463 ' H ' ' HB2' ' A' ' 60' ' ' PRO . 93.1 m-20 70.9 50.86 0.32 Allowed 'General case' 0 N--CA 1.464 0.253 0 CA-C-N 115.793 -0.64 . . . . 0.0 111.331 177.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 103.54 -0.58 46.15 Favored Glycine 0 N--CA 1.449 -0.499 0 CA-C-N 115.695 -0.684 . . . . 0.0 112.515 174.622 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' THR . . . . . 0.755 HG23 ' H ' ' A' ' 65' ' ' SER . 2.7 t -153.28 170.87 19.56 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-O 120.903 0.382 . . . . 0.0 110.54 -177.677 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -119.52 25.07 10.29 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-O 121.762 0.792 . . . . 0.0 109.203 177.526 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.755 ' H ' HG23 ' A' ' 63' ' ' THR . 5.5 m -110.77 172.48 6.84 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 114.676 -1.147 . . . . 0.0 111.622 -165.586 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.452 ' CB ' HD23 ' A' ' 37' ' ' LEU . . . -109.49 160.96 15.78 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 116.147 -0.479 . . . . 0.0 109.785 177.124 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.442 ' HA ' ' O ' ' A' ' 26' ' ' CYS . 40.3 ttmt -130.59 139.11 50.41 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 179.449 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLY . . . . . 0.509 ' HA3' HG21 ' A' ' 39' ' ' ILE . . . -126.36 119.65 3.47 Favored Glycine 0 N--CA 1.443 -0.866 0 C-N-CA 120.923 -0.656 . . . . 0.0 111.471 179.324 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.472 ' HA ' ' O ' ' A' ' 24' ' ' LEU . 46.6 t -108.48 123.98 64.57 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.621 0 CA-C-O 120.808 0.337 . . . . 0.0 110.818 -177.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 23' ' ' ASN . . . -115.98 137.15 52.37 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.081 176.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 44.7 m -98.99 116.09 30.44 Favored 'General case' 0 C--N 1.317 -0.815 0 CA-C-O 121.238 0.542 . . . . 0.0 110.144 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' VAL . . . . . 0.416 ' CG2' ' HB3' ' A' ' 22' ' ' ALA . 2.3 m -120.34 166.82 14.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.74 0 CA-C-N 115.283 -0.871 . . . . 0.0 109.692 -177.091 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 8.4 m -75.95 134.19 40.27 Favored 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 108.889 -0.782 . . . . 0.0 108.889 177.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.6 ' O ' ' HB2' ' A' ' 78' ' ' ASN . 2.6 p -53.02 -34.07 20.43 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.596 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 173.762 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -56.83 -40.81 76.71 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.417 -1.265 . . . . 0.0 111.456 178.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 61.7 m-20 -67.24 -44.67 78.84 Favored 'General case' 0 CA--C 1.516 -0.337 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.476 ' HA ' ' CE3' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -63.5 -42.01 98.53 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.707 -1.133 . . . . 0.0 109.824 176.643 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASN . . . . . 0.6 ' HB2' ' O ' ' A' ' 74' ' ' VAL . 7.5 t30 -73.11 -11.71 60.64 Favored 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 114.292 -1.322 . . . . 0.0 110.988 -176.314 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 93.4 m-20 -107.18 12.61 28.18 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.196 -0.456 . . . . 0.0 111.048 179.242 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.2 mtp180 65.74 37.85 5.53 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.376 -0.375 . . . . 0.0 111.783 176.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.2 mmtt -76.84 152.72 35.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.115 0.483 . . . . 0.0 111.545 178.023 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.556 ' HG2' ' HB2' ' A' ' 101' ' ' SER . 42.6 mt-10 -109.35 138.82 45.13 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.475 -0.784 . . . . 0.0 110.252 177.15 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -125.37 151.92 45.47 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.02 176.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' VAL . . . . . 0.528 ' HA ' ' O ' ' A' ' 98' ' ' LYS . 88.2 t -116.54 129.39 73.11 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.38 -176.954 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' CYS . . . . . 0.675 ' O ' ' HA ' ' A' ' 97' ' ' LYS . 43.3 t -105.89 131.87 52.69 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 109.673 -0.492 . . . . 0.0 109.673 175.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' THR . . . . . 0.549 HG22 ' HB2' ' A' ' 95' ' ' PRO . 0.2 OUTLIER -125.99 137.34 53.66 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 179.584 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.582 HG21 HG21 ' A' ' 28' ' ' VAL . 0.2 OUTLIER -128.29 133.46 66.82 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-O 121.197 0.522 . . . . 0.0 112.139 -173.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 2.6 p -114.93 100.44 8.2 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.681 -177.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' HIS . . . . . 0.518 ' ND1' HD13 ' A' ' 37' ' ' LEU . 18.5 t60 -99.79 -11.03 21.15 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.248 -0.433 . . . . 0.0 111.696 -177.489 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.429 ' HB3' ' O ' ' A' ' 89' ' ' HIS . 50.0 ttt180 74.06 -24.05 0.21 Allowed 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.045 0.538 . . . . 0.0 111.116 -177.752 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.442 ' H ' ' C ' ' A' ' 89' ' ' HIS . 39.0 t70 -71.97 -31.88 66.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.158 0.504 . . . . 0.0 110.46 -177.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -108.78 152.22 42.17 Favored Pre-proline 0 C--N 1.328 -0.368 0 CA-C-N 115.882 -0.599 . . . . 0.0 110.747 176.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -78.29 -21.87 10.09 Favored 'Trans proline' 0 C--N 1.344 0.338 0 C-N-CA 123.192 2.595 . . . . 0.0 113.249 -176.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . 0.475 ' HA ' ' HD2' ' A' ' 95' ' ' PRO . 57.4 p -125.76 114.95 24.71 Favored Pre-proline 0 C--N 1.322 -0.613 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.453 -179.614 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' PRO . . . . . 0.549 ' HB2' HG22 ' A' ' 86' ' ' THR . 16.3 Cg_endo -58.25 141.87 97.02 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 122.803 2.335 . . . . 0.0 111.228 176.92 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.511 ' O ' ' HA ' ' A' ' 86' ' ' THR . 44.4 mt-30 -91.19 128.47 37.02 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 120.237 -0.585 . . . . 0.0 110.761 -173.24 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.675 ' HA ' ' O ' ' A' ' 85' ' ' CYS . 18.6 ptmt -111.52 130.19 55.81 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 121.211 0.529 . . . . 0.0 110.827 179.28 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.528 ' O ' ' HA ' ' A' ' 84' ' ' VAL . 68.1 mmtt -121.56 152.91 38.71 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.733 -177.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -110.5 130.48 55.55 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.385 -179.076 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' ILE . . . . . 0.47 HD11 ' HA ' ' A' ' 10' ' ' PRO . 16.0 tt -126.84 144.12 38.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.582 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 177.772 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' SER . . . . . 0.556 ' HB2' ' HG2' ' A' ' 82' ' ' GLU . 29.5 t -156.77 151.0 25.16 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.372 -0.377 . . . . 0.0 110.503 -175.763 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.446 ' HB2' ' CE2' ' A' ' 77' ' ' TRP . 13.8 tmtt? . . . . . 0 C--O 1.246 0.894 0 CA-C-O 118.725 -0.655 . . . . 0.0 110.078 179.087 . . . . . . . . 1 1 . 1 stop_ save_