data_3zd0_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 3zd0 _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 ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 C--O 1.231 0.166 0 CA-C-O 120.752 0.23 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.95 -38.28 90.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.682 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.62 ' HE2' ' CE1' ' A' ' 8' ' ' PHE . 74.7 t80 -70.96 -31.73 68.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.567 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.24 -40.97 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.217 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.22 83.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.263 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -68.25 -38.66 82.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -60.76 -41.76 96.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.034 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -63.34 -30.54 71.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.802 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -70.24 -47.94 59.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.55 -31.26 72.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -72.09 -32.48 67.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -75.85 -40.93 53.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -68.19 -41.95 80.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.876 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.497 ' HZ3' HD22 ' A' ' 23' ' ' ASN . 6.8 tmtm? -63.51 -37.0 85.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.637 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.77 -53.0 46.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.155 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.494 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.38 -46.6 73.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.877 -179.084 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.494 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.3 pt-20 -65.68 -32.47 74.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.741 0.305 . . . . 0.0 111.399 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.497 HD22 ' HZ3' ' A' ' 19' ' ' LYS . 0.9 OUTLIER -67.07 -54.49 20.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.746 0.308 . . . . 0.0 111.256 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.7 mt -50.72 -52.02 44.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG21 ' N ' ' A' ' 26' ' ' VAL . 32.7 m -54.84 -42.75 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.435 ' N ' HG21 ' A' ' 25' ' ' VAL . 53.6 t -77.01 -51.64 18.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.61 0.243 . . . . 0.0 111.48 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 11.0 mp -53.51 -35.13 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -62.38 -38.01 87.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.307 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.655 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -67.34 -32.57 73.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.763 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.488 ' HB2' HD11 ' A' ' 71' ' ' LEU . . . -69.68 -41.27 75.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.304 0.573 . . . . 0.0 109.508 177.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.1 t -67.39 -36.91 82.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.359 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.655 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -68.25 -43.63 84.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.96 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.433 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.32 -42.87 99.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.91 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.42 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -63.15 -49.67 69.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.117 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.524 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -65.53 -20.66 66.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.102 178.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.8 m-70 -75.79 -31.9 59.66 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.562 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.58 -33.47 58.24 Favored Glycine 0 N--CA 1.435 -1.393 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.097 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.598 ' O ' HD21 ' A' ' 42' ' ' LEU . 11.9 tt -78.25 -35.99 20.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.45 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.646 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.18 -36.49 58.66 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.646 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -70.97 -38.26 72.76 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 120.798 0.332 . . . . 0.0 111.015 -178.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.503 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.48 -33.5 54.51 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.471 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.598 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -57.93 -46.47 84.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.971 0.891 . . . . 0.0 108.698 176.238 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.0 t -70.42 -53.26 23.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.093 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.621 ' HD2' ' CD1' ' A' ' 44' ' ' PHE . 7.6 m-85 -76.21 -54.39 6.87 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.623 ' HD2' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -75.82 -45.7 34.49 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 113.886 -1.507 . . . . 0.0 114.556 -175.266 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.623 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 16.1 t -54.9 -80.85 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.054 0.388 . . . . 0.0 111.356 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 51.16 -147.98 0.38 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.3 7.87 9.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.928 0.394 . . . . 0.0 110.865 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -90.97 -25.39 19.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.191 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.607 ' HE2' ' CE1' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -69.27 -26.29 64.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.563 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 48' ' ' ALA . 38.9 pt -68.9 -29.48 43.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.823 0.344 . . . . 0.0 111.055 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -55.08 -39.16 68.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.839 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 162.33 34.06 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.881 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.523 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.2 ttm180 -129.12 95.98 4.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.876 0.846 . . . . 0.0 110.569 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.461 ' O ' ' N ' ' A' ' 58' ' ' GLY . 44.8 mt -75.64 -20.11 58.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.726 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -26.48 -54.82 0.2 Allowed Pre-proline 0 N--CA 1.47 0.542 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 56' ' ' ALA . 86.5 Cg_exo -48.74 -42.9 35.95 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.696 1.597 . . . . 0.0 112.056 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.76 -49.24 41.77 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.42 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.52 -38.91 91.81 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.896 -0.652 . . . . 0.0 111.262 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.91 -35.56 80.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.343 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.623 ' HH ' ' HB2' ' A' ' 46' ' ' CYS . 3.7 m-85 -73.57 -43.13 60.58 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.826 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.9 -39.31 83.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.013 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.642 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -70.76 -54.85 10.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.605 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 1.4 m-85 -78.12 -23.28 47.9 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.22 -29.87 48.47 Favored Glycine 0 CA--C 1.518 0.263 0 C-N-CA 119.736 -1.221 . . . . 0.0 111.521 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.27 -27.21 4.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.17 -49.95 78.43 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.913 178.534 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.771 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.8 Cg_endo -65.78 -38.05 25.35 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.161 2.574 . . . . 0.0 112.071 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.74 -55.13 39.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.447 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.1 mp -56.24 -51.12 69.28 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.783 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 30' ' ' ALA . 77.5 mt -51.21 -49.41 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.387 0.429 . . . . 0.0 111.667 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.569 HD13 HD21 ' A' ' 27' ' ' LEU . 31.0 tp -57.12 -45.76 83.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.712 0.291 . . . . 0.0 111.229 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.25 -38.61 71.91 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -81.59 -23.62 36.97 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.733 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.575 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -91.42 -0.38 57.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.41 0.624 . . . . 0.0 109.377 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.433 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 18.9 tp . . . . . 0 CA--C 1.531 0.244 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.366 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 C--O 1.231 0.162 0 N-CA-C 112.658 0.214 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.43 -49.61 70.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.659 ' HE2' ' CE1' ' A' ' 8' ' ' PHE . 71.6 m-85 -67.23 -42.45 83.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.218 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.21 -36.75 80.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.13 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.7 -37.09 67.94 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.3 tpp -65.91 -34.88 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -66.0 -35.79 81.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -64.64 -41.99 95.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.695 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -64.95 -48.73 73.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.108 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -63.49 -33.29 75.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.422 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.07 -33.91 65.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.066 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -73.79 -40.76 63.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.965 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.98 -35.32 76.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.948 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -66.0 -40.71 91.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.76 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.574 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.31 -48.12 74.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.62 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -49.52 69.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.44 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.64 -31.46 71.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.366 . . . . 0.0 110.723 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.504 ' O ' HD12 ' A' ' 27' ' ' LEU . 26.8 t-20 -61.42 -53.86 51.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.968 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.8 mt -55.55 -39.88 71.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.799 0.333 . . . . 0.0 110.672 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.74 -46.12 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.909 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.4 t -73.6 -41.05 55.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.538 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.562 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 11.1 mp -58.6 -27.6 64.81 Favored 'General case' 0 CA--C 1.522 -0.102 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.81 -32.57 71.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.218 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.645 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -74.32 -36.05 63.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.884 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.452 ' HB2' HD11 ' A' ' 71' ' ' LEU . . . -69.09 -40.41 78.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.3 t -67.66 -39.42 84.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.276 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.645 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.6 -41.59 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.5 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.8 -41.08 97.3 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.457 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.31 -49.97 69.29 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.183 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.565 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.96 -20.18 65.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.32 -0.44 . . . . 0.0 110.262 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.8 m-70 -75.77 -31.68 59.61 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.61 -31.5 56.28 Favored Glycine 0 N--CA 1.433 -1.564 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.511 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.565 HG23 ' O ' ' A' ' 35' ' ' ALA . 13.9 tt -78.43 -35.11 18.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.215 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.67 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.94 -35.79 50.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.896 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.67 ' N ' HD13 ' A' ' 39' ' ' LEU . 36.8 p -71.52 -37.96 71.14 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.072 0.463 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.648 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 15.6 m-85 -75.56 -35.9 60.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.483 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.466 HD12 HG12 ' A' ' 38' ' ' ILE . 2.2 mp -56.89 -43.71 81.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 82.2 t -70.86 -47.79 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.751 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.667 ' HE1' ' CE2' ' A' ' 44' ' ' PHE . 0.2 OUTLIER -75.47 -53.7 8.23 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -178.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.643 ' HE1' ' CE2' ' A' ' 45' ' ' PHE . 17.0 m-85 -80.98 -48.15 12.66 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.572 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.0 t -62.19 1.99 0.27 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.703 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.575 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -44.54 153.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.425 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.94 5.69 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.575 ' H ' ' C ' ' A' ' 47' ' ' ALA . 38.8 m95 -90.2 -23.49 21.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.603 0.24 . . . . 0.0 111.076 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.62 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -69.03 -14.09 62.83 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.865 0.364 . . . . 0.0 110.755 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 48' ' ' ALA . 14.6 pt -68.55 -26.9 34.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.511 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -52.35 -39.77 61.12 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.357 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.08 39.14 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.986 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.5 ptt180 -135.11 102.34 5.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.751 0.786 . . . . 0.0 111.619 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.452 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -73.17 -17.5 61.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.522 178.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.536 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.05 -51.86 0.15 Allowed Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.728 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.1 Cg_exo -47.82 -48.5 15.85 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.418 1.412 . . . . 0.0 112.019 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.57 -48.26 28.73 Favored Glycine 0 CA--C 1.508 -0.37 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.066 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.94 93.81 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.357 -0.421 . . . . 0.0 111.969 -178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.433 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.47 -31.5 72.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.313 0.578 . . . . 0.0 110.175 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.639 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -78.05 -45.13 24.42 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.207 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -35.87 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.239 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.643 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.4 t80 -71.33 -55.29 8.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.328 -179.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.765 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -78.33 -23.19 47.12 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.444 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -79.31 -29.39 49.99 Favored Glycine 0 CA--C 1.517 0.194 0 C-N-CA 119.994 -1.098 . . . . 0.0 111.29 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.82 -28.46 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.649 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.29 -49.91 73.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.669 178.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.4 Cg_endo -62.75 -39.51 42.27 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.887 2.391 . . . . 0.0 111.611 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 73' ' ' LEU . 10.1 tt -57.36 -59.41 5.18 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.455 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.0 mp -51.02 -50.82 57.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.729 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.452 HD11 ' HB2' ' A' ' 30' ' ' ALA . 98.2 mt -52.62 -45.6 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.275 0.36 . . . . 0.0 111.75 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.19 -44.74 95.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.341 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 69' ' ' LEU . 10.4 mp -71.54 -38.58 71.04 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.455 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -80.57 -28.04 37.31 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.743 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.562 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -86.87 -0.04 55.78 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 39.6 tp . . . . . 0 C--O 1.231 0.117 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.91 179.362 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.472 0.209 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.25 -45.28 93.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.497 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.628 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 86.6 t80 -69.3 -37.23 77.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.185 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.92 -33.52 73.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.294 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.77 -41.48 62.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.76 -32.0 73.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.796 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.95 -37.27 83.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.745 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.65 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 92.6 t80 -64.22 -45.26 89.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.001 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -61.85 -51.09 69.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -60.45 -39.97 89.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.267 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.33 -34.74 78.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.096 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -74.3 -37.27 63.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -70.55 -32.88 70.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.981 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -72.23 -38.33 68.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.826 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.94 -50.36 56.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.43 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.96 -48.68 72.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.271 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.43 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.8 pt-20 -63.96 -33.98 76.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.622 0.248 . . . . 0.0 110.794 -179.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.547 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 7.7 m120 -58.83 -52.55 65.26 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 2.4 mt -48.17 -50.4 29.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.524 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.1 t -49.75 -53.92 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.276 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.56 -45.66 77.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 73.3 mt -61.52 -24.34 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.705 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -67.27 -30.4 70.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.641 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.84 -31.28 66.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.007 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.98 76.71 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.49 ' HB2' HD22 ' A' ' 72' ' ' LEU . 33.7 t -65.32 -43.27 91.54 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.997 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.641 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -62.28 -40.43 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.51 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.519 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.44 -43.18 99.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.608 179.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.425 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.75 -49.54 75.12 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.559 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.81 -19.94 65.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.146 -0.527 . . . . 0.0 110.352 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.507 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.7 m-70 -76.17 -31.57 58.58 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.605 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.26 -32.0 56.37 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.531 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.565 ' O ' HD21 ' A' ' 42' ' ' LEU . 12.9 tt -77.67 -36.2 22.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.285 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.672 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.08 -36.29 55.92 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.672 ' N ' HD13 ' A' ' 39' ' ' LEU . 48.6 p -71.15 -36.37 72.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 110.649 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 17.0 m-85 -78.23 -35.98 47.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.565 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -55.74 -46.11 77.86 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.92 0.867 . . . . 0.0 108.709 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 97.8 t -70.33 -49.36 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.123 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.637 ' HD1' ' CD2' ' A' ' 44' ' ' PHE . 1.4 m-85 -75.98 -54.0 7.53 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.708 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 6.8 m-85 -77.18 -48.68 16.97 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.463 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.4 t -53.1 -81.28 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.568 -175.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 41.51 -141.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.451 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 13.11 9.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.885 0.374 . . . . 0.0 110.729 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 20.1 m95 -91.18 -26.27 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.264 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 1.4 p90 -69.02 -31.55 70.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.332 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.8 pt -61.34 -28.15 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.873 0.368 . . . . 0.0 110.436 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -54.06 -50.89 65.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.077 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.25 40.62 0.04 OUTLIER Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.035 -1.079 . . . . 0.0 113.877 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.549 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 8.0 ptm180 -148.39 105.46 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.741 0.782 . . . . 0.0 111.83 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.432 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.3 pp -74.46 -17.8 60.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.597 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.56 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -24.81 -51.98 0.15 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.708 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 90.7 Cg_exo -47.86 -49.17 14.26 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.331 1.354 . . . . 0.0 111.878 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -49.15 -49.68 29.98 Favored Glycine 0 CA--C 1.505 -0.564 0 CA-C-N 115.995 -0.548 . . . . 0.0 113.616 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.67 -42.42 99.61 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.017 -0.592 . . . . 0.0 111.619 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.43 -36.97 76.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.296 0.57 . . . . 0.0 110.217 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.609 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.2 m-30 -72.07 -46.49 56.67 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.025 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.8 88.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.704 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.611 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.4 m-85 -71.51 -54.18 11.41 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.653 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.4 OUTLIER -77.66 -24.59 49.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.78 -31.54 43.97 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.54 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.26 -25.79 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.621 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.05 -51.69 59.64 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.639 178.331 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.72 -39.4 26.76 Favored 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 122.95 2.434 . . . . 0.0 112.257 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tt -58.26 -54.42 47.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.844 0.354 . . . . 0.0 110.415 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.49 ' HG ' HD22 ' A' ' 74' ' ' LEU . 6.4 tp -58.01 -53.8 54.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.37 -52.57 27.46 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.49 HD22 ' HB2' ' A' ' 31' ' ' SER . 2.7 mm? -57.55 -45.08 85.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 85.5 mt -69.62 -38.45 77.23 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.49 HD22 ' HG ' ' A' ' 70' ' ' LEU . 1.7 pp -82.27 -19.97 38.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.028 0.442 . . . . 0.0 110.201 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.419 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -93.95 -7.17 43.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.761 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.2 tp . . . . . 0 CA--C 1.532 0.26 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.129 179.541 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 C--O 1.232 0.201 0 N-CA-C 112.682 0.224 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.59 -56.12 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.468 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.622 ' HD2' ' CD1' ' A' ' 8' ' ' PHE . 65.4 m-85 -68.18 -31.38 70.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.525 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -44.27 83.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.52 -27.6 63.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.055 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.9 ttt -73.7 -38.19 64.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.12 -33.32 75.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.836 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -69.17 -37.62 78.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -69.35 -42.07 75.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.795 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -66.26 -43.86 85.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.947 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.68 -38.37 90.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.945 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -70.73 -36.65 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.828 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -70.72 -34.22 71.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.056 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -71.1 -39.44 72.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.463 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.25 -47.8 75.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -49.64 73.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.634 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.47 -33.25 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.76 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.457 ' O ' HD11 ' A' ' 27' ' ' LEU . 9.7 m120 -60.7 -41.09 94.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.434 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.6 mt -59.51 -48.34 82.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 110.786 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.4 t -49.87 -53.58 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.371 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.619 HG21 HD11 ' A' ' 27' ' ' LEU . 4.8 m -71.49 -39.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.424 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.619 HD11 HG21 ' A' ' 26' ' ' VAL . 1.5 mp -63.66 -24.24 67.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.285 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -69.53 -32.11 70.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.627 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.53 -33.9 67.19 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.725 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.47 -43.79 72.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.281 0.562 . . . . 0.0 109.623 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -64.18 -38.67 91.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.203 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.627 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.6 OUTLIER -66.26 -40.56 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.448 179.023 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.519 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.64 -43.28 93.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.514 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.14 77.18 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 178.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.535 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.08 -20.47 66.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.085 -0.558 . . . . 0.0 110.109 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.3 m-70 -75.99 -32.32 59.4 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.575 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.07 -34.08 58.85 Favored Glycine 0 N--CA 1.433 -1.542 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.888 178.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.59 ' O ' HD11 ' A' ' 42' ' ' LEU . 17.5 tt -77.27 -37.22 25.28 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.359 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.664 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.25 -38.23 60.62 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.664 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.54 -38.57 77.53 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.252 -178.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.671 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 12.0 m-85 -77.68 -33.49 53.25 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.577 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.59 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.28 -47.07 82.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.919 0.866 . . . . 0.0 108.838 176.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.83 -54.41 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.169 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.653 ' HD1' ' CD2' ' A' ' 44' ' ' PHE . 27.4 m-85 -76.36 -54.42 6.78 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.612 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.32 -46.0 52.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 113.877 -1.51 . . . . 0.0 114.395 -175.347 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.522 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -60.02 -81.42 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.445 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.76 -141.08 0.36 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -119.08 9.97 11.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 -90.26 -27.94 19.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.626 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 1.2 p90 -66.85 -40.21 87.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.824 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -28.73 45.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -54.82 -52.05 63.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.825 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.02 44.77 0.06 OUTLIER Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.375 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.482 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 17.2 ptp180 -157.68 102.44 1.87 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.696 0.76 . . . . 0.0 111.653 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 pp -73.9 -18.38 60.91 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.167 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.567 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.17 -52.99 0.17 Allowed Pre-proline 0 N--CA 1.47 0.534 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.61 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -48.37 -42.9 33.68 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 121.486 1.457 . . . . 0.0 112.16 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -46.91 48.77 Favored Glycine 0 CA--C 1.505 -0.535 0 CA-C-N 115.905 -0.588 . . . . 0.0 113.105 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.06 89.7 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.804 -0.698 . . . . 0.0 111.447 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.46 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -64.62 -32.06 73.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.02 0.438 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.61 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -76.37 -49.35 17.05 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.333 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.25 93.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.836 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 1.66 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 24.5 t80 -71.15 -54.71 10.1 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.773 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.57 -23.94 49.89 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.789 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.52 -29.47 48.71 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.672 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 p -91.28 -29.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.663 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.76 -50.43 73.58 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.187 179.123 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.773 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.37 -40.46 24.75 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 C-N-CA 122.962 2.442 . . . . 0.0 112.075 -178.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.93 -54.75 43.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.382 . . . . 0.0 110.01 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.404 ' O ' HD22 ' A' ' 74' ' ' LEU . 71.7 mt -57.97 -53.34 59.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.411 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 86.7 mt -49.58 -52.87 27.16 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.433 0.458 . . . . 0.0 112.11 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.81 -46.21 81.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.634 0.254 . . . . 0.0 111.614 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.6 -37.96 77.11 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.62 -21.72 35.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.002 0.429 . . . . 0.0 110.243 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -91.25 -10.41 41.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.581 178.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 24.8 tp . . . . . 0 CA--C 1.533 0.304 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 179.445 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo . . . . . 0 C--O 1.23 0.109 0 CA-C-O 120.915 0.298 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.06 -43.45 98.87 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.047 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -69.22 -47.75 63.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.78 -37.07 78.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.277 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.44 -32.55 64.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.453 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 44.2 ttp -69.54 -45.48 68.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.016 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.12 -31.44 71.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.755 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.635 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 73.9 t80 -66.61 -40.71 88.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.737 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . 0.4 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 24.6 ttmm -64.26 -48.0 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.706 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.35 -24.26 66.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.17 -53.18 13.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.093 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.4 ' OD2' ' HA ' ' A' ' 14' ' ' LYS . 3.0 p30 -67.63 -30.81 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.978 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -68.83 -45.64 70.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.014 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -64.9 -36.56 84.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.488 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -63.72 -51.3 65.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.402 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.9 -49.51 71.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.638 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.402 ' N ' HD21 ' A' ' 21' ' ' LEU . 11.4 pt-20 -63.68 -35.07 79.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.724 0.297 . . . . 0.0 111.141 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.469 ' O ' HD11 ' A' ' 27' ' ' LEU . 9.9 m120 -59.82 -43.76 94.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.687 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.9 mt -58.08 -48.58 79.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.03 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 t -49.68 -53.69 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.193 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.565 HG21 HD11 ' A' ' 27' ' ' LEU . 4.3 m -72.07 -38.64 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.59 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.565 HD11 HG21 ' A' ' 26' ' ' VAL . 1.9 mp -63.96 -24.85 67.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.272 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -70.01 -30.0 67.2 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.642 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.96 -34.77 66.71 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.419 178.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.12 78.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.448 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.1 t -66.71 -38.63 87.13 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.642 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -66.52 -41.66 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.508 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.94 -43.86 94.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.487 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.6 -49.54 75.66 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.583 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.36 -22.16 66.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.067 -0.567 . . . . 0.0 110.238 178.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.525 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.2 m-70 -75.6 -31.76 60.05 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.555 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.25 -33.9 58.56 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.946 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.616 ' O ' HD11 ' A' ' 42' ' ' LEU . 20.0 tt -77.89 -36.57 22.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.512 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.666 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.7 -37.06 59.79 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.666 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.71 -38.82 77.09 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.489 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 12.5 m-85 -77.6 -32.5 53.64 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.619 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.616 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.76 -46.75 84.1 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 91.9 t -69.9 -54.16 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 114.949 -1.023 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -76.23 -54.93 6.08 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.608 ' HD2' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.98 -38.15 64.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 113.679 -1.601 . . . . 0.0 114.447 -175.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.666 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 7.4 t -70.57 16.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.849 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.537 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -50.18 156.59 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.85 8.79 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.537 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.83 -25.84 19.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.659 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.22 63.53 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.616 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 48' ' ' ALA . 30.7 pt -70.03 -29.26 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.287 . . . . 0.0 111.022 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -54.71 -29.91 54.57 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 149.52 30.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 113.138 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.0 ttm180 -122.52 98.77 6.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.825 0.821 . . . . 0.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -75.13 -18.87 60.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.404 179.219 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.575 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.9 -54.49 0.19 Allowed Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.575 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 79.8 Cg_exo -49.09 -45.09 30.74 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.492 1.462 . . . . 0.0 112.027 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.53 -47.26 45.17 Favored Glycine 0 CA--C 1.506 -0.524 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.345 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.57 94.87 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.945 -0.627 . . . . 0.0 111.496 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.489 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.96 -35.13 79.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 0.0 110.238 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.612 ' HD2' ' CD1' ' A' ' 61' ' ' TYR . 3.1 m-30 -73.15 -43.81 60.99 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.863 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.7 -39.44 84.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.007 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 1.644 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 8.3 m-85 -71.01 -54.64 10.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.586 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 1.1 m-85 -77.76 -24.06 49.1 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.36 45.7 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.056 -1.069 . . . . 0.0 111.721 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -91.13 -27.51 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.109 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.43 -50.57 75.76 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.114 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.792 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.6 Cg_endo -64.96 -40.51 20.49 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.112 2.541 . . . . 0.0 112.155 -178.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -55.79 30.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.107 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.425 ' O ' HD22 ' A' ' 74' ' ' LEU . 96.5 mt -57.03 -52.61 64.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.223 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 71.7 mt -49.63 -53.64 22.98 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.362 0.414 . . . . 0.0 112.073 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.424 HD13 HD21 ' A' ' 27' ' ' LEU . 40.2 tp -57.59 -44.7 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.45 -39.67 81.38 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.425 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.3 pp -82.65 -20.15 36.86 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.214 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.489 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -92.15 -9.51 42.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.523 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.5 tp . . . . . 0 CA--C 1.532 0.271 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.114 179.478 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.666 0.194 . . . . 0.0 112.568 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.31 -38.82 84.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.81 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -71.54 -35.47 70.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.85 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.91 -34.91 74.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.089 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.55 -48.85 45.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.427 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 91.6 mtp -59.89 -43.62 94.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.99 -37.22 76.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.639 ' HD1' ' CD2' ' A' ' 13' ' ' TYR . 87.0 t80 -60.02 -51.2 70.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.954 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -60.2 -36.71 78.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -66.34 -37.73 86.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.688 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.55 -45.13 76.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.9 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -67.93 -31.95 72.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.539 ' HA ' HD21 ' A' ' 21' ' ' LEU . 15.6 t70 -67.96 -49.54 61.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.815 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -62.57 -28.59 69.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.719 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.16 66.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.472 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.674 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.1 pp -62.4 -44.13 97.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.674 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 11.9 pt-20 -68.44 -37.58 80.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.594 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -66.15 -55.02 18.42 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.973 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.7 tp -52.23 -52.0 55.0 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 22' ' ' GLU . 18.8 m -52.34 -44.49 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.443 ' N ' HG21 ' A' ' 25' ' ' VAL . 53.0 t -75.46 -41.18 42.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.796 0.332 . . . . 0.0 110.993 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 87.2 mt -63.7 -22.43 66.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.412 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -69.65 -30.39 68.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.633 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.44 -33.63 65.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.442 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.03 76.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.6 t -65.53 -41.08 93.47 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.06 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.633 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.65 -38.89 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.516 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.61 -41.75 97.9 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.277 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.463 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.11 -49.65 72.93 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.574 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.47 -21.21 66.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.926 -0.637 . . . . 0.0 110.254 178.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.504 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.4 m-70 -75.59 -31.75 60.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.603 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.28 -32.95 57.51 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.861 178.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.584 ' O ' HD11 ' A' ' 42' ' ' LEU . 14.0 tt -77.92 -36.08 21.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.335 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.677 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.85 -35.97 57.12 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.989 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.677 ' N ' HD13 ' A' ' 39' ' ' LEU . 32.8 p -70.83 -38.14 73.23 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.071 0.462 . . . . 0.0 110.537 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.449 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 16.4 m-85 -76.01 -35.24 59.62 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.389 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.584 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.5 mp -56.21 -45.49 79.84 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.941 0.877 . . . . 0.0 108.763 176.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.98 -48.22 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.097 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 0.8 OUTLIER -75.77 -53.84 7.87 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -177.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.694 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.4 m-85 -78.82 -48.71 14.24 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.469 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 29.4 t -52.5 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.029 -0.669 . . . . 0.0 111.913 -175.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 44.73 -143.16 0.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.74 12.18 9.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.976 0.417 . . . . 0.0 110.846 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.9 m95 -91.13 -28.64 17.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.208 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.491 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.26 -28.22 66.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.527 -179.18 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.9 pt -65.06 -28.9 45.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.329 . . . . 0.0 111.067 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -54.56 -32.01 57.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.034 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 150.57 44.88 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.608 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -141.78 100.96 3.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.644 0.735 . . . . 0.0 110.664 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.85 -20.03 58.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.249 178.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.96 -54.03 0.19 Allowed Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.694 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.6 Cg_exo -50.14 -47.89 22.08 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.694 1.596 . . . . 0.0 111.94 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.58 -48.03 29.02 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.747 -0.661 . . . . 0.0 113.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.91 -42.86 97.31 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.134 -0.533 . . . . 0.0 111.794 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.449 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.72 -34.7 73.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.304 0.573 . . . . 0.0 110.153 179.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.606 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -74.1 -46.24 44.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.969 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.98 92.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.632 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 63' ' ' PHE . 8.9 m-85 -71.34 -54.77 9.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.653 ' HD2' ' CD1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -77.67 -24.31 49.39 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.7 -32.15 42.28 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.493 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.21 -26.11 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.662 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.12 -51.0 72.15 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.942 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.0 Cg_endo -64.44 -40.14 25.67 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 122.841 2.36 . . . . 0.0 112.132 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -57.92 -56.22 24.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.955 0.407 . . . . 0.0 110.342 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.43 ' O ' HD22 ' A' ' 74' ' ' LEU . 63.0 mt -57.44 -54.15 50.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.426 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.4 mt -48.88 -50.95 32.46 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.395 0.434 . . . . 0.0 112.011 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 2.4 tt -59.21 -50.57 73.51 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.655 -179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.57 -37.71 88.51 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 70' ' ' LEU . 2.0 pp -81.6 -24.34 36.5 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.377 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.428 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -90.51 -7.63 52.46 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.369 0.604 . . . . 0.0 109.525 178.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.4 tm? . . . . . 0 CA--C 1.532 0.275 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.496 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--O 1.23 0.123 0 N-CA-C 112.751 0.251 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.29 -46.6 82.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.706 0.288 . . . . 0.0 111.155 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -67.34 -36.99 82.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.08 -42.58 84.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.61 -43.41 98.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.989 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.0 ttt -62.87 -34.28 77.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.636 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.06 -42.56 99.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.984 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -63.63 -33.76 76.33 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -69.8 -52.64 23.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -61.09 -32.26 71.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.151 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.93 -31.53 68.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.857 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -77.41 -43.66 31.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.061 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.98 -34.43 78.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.283 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -68.23 -48.91 63.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.226 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.18 78.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.338 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.484 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.01 -46.46 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.546 -179.74 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.484 ' N ' HD21 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -66.75 -37.11 83.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.677 0.275 . . . . 0.0 111.099 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.445 ' O ' HD11 ' A' ' 27' ' ' LEU . 95.2 m-20 -63.13 -38.76 92.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.0 110.613 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.51 -53.65 55.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.454 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.448 HG21 ' O ' ' A' ' 21' ' ' LEU . 23.1 t -51.44 -48.22 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.494 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.563 HG11 HD11 ' A' ' 27' ' ' LEU . 7.4 p -73.32 -36.2 48.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.656 0.265 . . . . 0.0 111.074 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.563 HD11 HG11 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -65.92 -24.01 66.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.034 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.38 -30.6 68.63 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.636 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.32 -33.69 65.28 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.463 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.47 74.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.452 0.644 . . . . 0.0 109.346 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.1 m -65.23 -40.61 94.3 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.318 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.636 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -63.08 -39.62 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.5 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.5 -41.45 97.3 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.381 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.17 -49.74 71.9 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.564 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.75 -20.18 65.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.157 -0.522 . . . . 0.0 110.176 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.5 m-70 -75.72 -33.21 60.29 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.607 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.33 -32.91 59.48 Favored Glycine 0 N--CA 1.43 -1.748 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.43 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.564 HG23 ' O ' ' A' ' 35' ' ' ALA . 12.4 tt -77.46 -36.63 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.527 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.634 HD13 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.93 -38.85 57.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.634 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -71.19 -36.17 71.83 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.981 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.417 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 13.1 m-85 -76.1 -35.93 59.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.121 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.488 HD11 ' CE1' ' A' ' 61' ' ' TYR . 1.8 mp -56.05 -44.83 79.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.1 t -70.91 -48.28 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.941 -1.027 . . . . 0.0 112.048 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -53.77 8.12 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.75 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.8 m-85 -79.23 -47.72 15.46 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -176.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.529 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.2 t -60.78 -0.53 0.29 Allowed 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.549 -175.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.561 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -46.9 161.18 0.07 Allowed 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -62.77 10.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.561 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.29 -26.3 20.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.778 0.323 . . . . 0.0 110.532 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -69.48 -33.1 72.38 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.219 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.6 pt -59.56 -27.7 38.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.899 0.38 . . . . 0.0 110.687 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -53.27 -42.39 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.087 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.89 48.62 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.053 -1.07 . . . . 0.0 113.52 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 13.4 ptp180 -154.88 107.13 2.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.741 0.782 . . . . 0.0 111.708 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.447 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 4.4 pp -74.12 -16.84 61.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.618 178.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -23.99 -51.52 0.12 Allowed Pre-proline 0 N--CA 1.467 0.384 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.75 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 82.3 Cg_exo -47.39 -49.96 12.14 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 121.379 1.386 . . . . 0.0 111.823 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.39 -48.07 27.84 Favored Glycine 0 CA--C 1.509 -0.307 0 CA-C-N 115.879 -0.6 . . . . 0.0 113.905 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.27 97.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.141 -0.529 . . . . 0.0 112.049 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.4 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.189 0.519 . . . . 0.0 110.126 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.633 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -75.45 -45.03 41.13 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.179 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.05 83.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.683 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 23.5 t80 -71.19 -54.54 10.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.29 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.652 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -77.62 -23.77 49.73 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.466 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -80.02 -29.19 47.39 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.614 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -90.94 -29.08 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.683 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.81 -50.44 73.83 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.978 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.783 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.6 Cg_endo -63.84 -39.57 32.89 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.933 2.422 . . . . 0.0 111.902 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.1 -58.24 9.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.918 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.3 mp -56.62 -51.51 68.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.32 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.2 mt -49.33 -52.64 26.64 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 47.6 tp -59.31 -44.25 92.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.4 tp -70.34 -39.08 74.9 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.91 -25.79 34.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.005 0.431 . . . . 0.0 110.411 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.52 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -85.79 -8.55 58.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 33.8 tp . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.777 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.708 0.212 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -58.1 -50.35 73.78 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.665 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 88.9 m-85 -64.19 -36.47 84.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -32.7 73.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.57 -36.79 60.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.082 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 85.9 mtp -70.54 -35.66 73.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.23 -35.71 81.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.789 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -67.03 -36.34 81.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.387 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -66.46 -50.23 64.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.607 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.96 -41.33 91.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.865 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -62.53 -32.62 73.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.588 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.26 -41.71 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.675 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -66.43 -31.39 72.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -72.53 -35.68 68.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.724 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.19 -48.22 68.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.432 ' O ' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -57.68 -49.5 76.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.5 -35.7 81.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.666 0.269 . . . . 0.0 111.567 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.45 ' O ' HD11 ' A' ' 27' ' ' LEU . 11.0 m120 -65.87 -42.51 90.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.787 0.327 . . . . 0.0 111.012 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.08 -55.74 30.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 21' ' ' LEU . 2.3 m -52.81 -43.91 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.295 -178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -72.1 -41.59 67.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.807 0.337 . . . . 0.0 110.946 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HB3' HD21 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -64.67 -22.93 67.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.508 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -69.31 -34.25 74.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.633 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.95 -33.16 65.71 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.723 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -44.69 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.286 0.565 . . . . 0.0 109.601 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.406 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 43.2 t -64.37 -39.6 94.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.212 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.633 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -64.5 -40.76 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.246 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.484 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.39 -42.31 95.64 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.338 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.93 -49.36 76.39 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.01 -21.35 66.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.254 178.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.507 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 10.1 m-70 -75.96 -33.28 59.79 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.573 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.82 -33.42 60.17 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.924 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.598 ' O ' HD11 ' A' ' 42' ' ' LEU . 18.9 tt -77.78 -36.77 22.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.479 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.648 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.49 -37.95 59.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.648 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.19 -38.47 78.65 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 120.75 0.309 . . . . 0.0 111.016 -178.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.484 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 9.0 m-85 -77.9 -32.78 51.94 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.459 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -57.68 -46.99 83.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 122.024 0.916 . . . . 0.0 108.674 176.399 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 90.6 t -70.15 -53.92 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.007 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.63 ' HE1' ' CE2' ' A' ' 44' ' ' PHE . 12.3 m-85 -76.07 -54.28 7.08 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.521 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.31 -45.82 45.0 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.039 -1.437 . . . . 0.0 114.387 -175.331 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.531 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -61.09 -81.15 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.317 -179.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.97 -144.83 0.35 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.11 13.49 10.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.12 -35.3 14.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.011 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -63.2 -13.69 40.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.344 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.9 pt -67.05 -28.55 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.055 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -53.82 -29.6 41.46 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.684 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.11 30.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.749 . . . . 0.0 113.069 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.7 ttm180 -117.83 99.17 6.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.674 0.75 . . . . 0.0 110.253 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 58' ' ' GLY . 0.0 OUTLIER -74.71 -19.89 60.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.59 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -26.22 -54.21 0.19 Allowed Pre-proline 0 N--CA 1.467 0.418 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 88.0 Cg_exo -48.4 -45.83 25.33 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.589 1.526 . . . . 0.0 112.032 178.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.26 -47.03 43.48 Favored Glycine 0 CA--C 1.506 -0.496 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.411 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.29 95.93 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.9 -0.65 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.484 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.14 -33.38 74.37 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.108 0.48 . . . . 0.0 110.228 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.618 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 3.1 m-85 -75.26 -44.2 47.18 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.833 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.2 87.58 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.779 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.645 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.53 -54.65 9.85 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -77.68 -24.13 49.38 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.47 45.25 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.045 -1.074 . . . . 0.0 111.574 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.25 -26.74 5.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.647 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.35 -50.49 75.88 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.829 178.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.7 Cg_endo -64.06 -39.64 30.82 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 122.974 2.449 . . . . 0.0 111.973 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.29 -56.27 23.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.048 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -57.32 -52.81 63.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.418 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.2 mt -49.28 -52.9 24.62 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 3.2 tm? -56.59 -45.17 81.55 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.6 mt -71.14 -39.09 72.19 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.69 -21.02 38.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.969 0.414 . . . . 0.0 110.5 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.493 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -93.65 -8.99 39.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.88 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.51 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 5.1 tp . . . . . 0 C--N 1.332 -0.153 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.404 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.664 0.193 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.34 -53.17 61.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -66.31 -38.79 88.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.354 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.69 84.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.56 -36.93 68.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.979 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 tpp -65.81 -41.61 91.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.43 -37.73 81.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.728 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -62.31 -43.45 98.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.673 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -62.9 -55.33 26.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.015 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -57.45 -32.51 67.0 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.377 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.06 -44.07 77.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -69.45 -33.1 72.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.75 -37.27 73.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.165 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -70.95 -34.79 71.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -68.72 -52.83 26.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.439 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.23 -45.19 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.496 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.439 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.7 pt-20 -66.95 -30.98 71.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.864 0.364 . . . . 0.0 110.736 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.472 ' O ' HD11 ' A' ' 27' ' ' LEU . 7.3 m-20 -68.0 -42.33 80.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.232 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.9 mt -62.78 -51.51 66.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.737 0.303 . . . . 0.0 111.715 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.434 HG21 ' N ' ' A' ' 26' ' ' VAL . 34.6 m -53.2 -45.43 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.558 HG11 HD11 ' A' ' 27' ' ' LEU . 8.3 p -74.91 -37.51 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.778 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.558 HD11 HG11 ' A' ' 26' ' ' VAL . 1.2 mp -64.32 -22.92 67.12 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.857 -0.424 . . . . 0.0 109.857 179.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -70.39 -31.2 68.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.294 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.624 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.14 -35.31 66.47 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.46 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.83 -38.89 80.16 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.418 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 32.9 t -66.81 -40.47 88.07 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.075 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.49 -39.24 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.021 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.517 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.09 -43.4 98.94 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.387 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.422 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.84 -49.3 77.25 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.561 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -65.91 -21.59 66.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.071 -0.565 . . . . 0.0 110.284 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.493 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 8.1 m-70 -73.89 -31.9 63.33 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.582 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.54 -32.5 57.53 Favored Glycine 0 N--CA 1.434 -1.437 0 CA-C-N 114.086 -1.415 . . . . 0.0 111.006 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.58 ' O ' HD11 ' A' ' 42' ' ' LEU . 14.6 tt -78.13 -35.97 20.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.279 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.672 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.11 -35.43 56.38 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.672 ' N ' HD13 ' A' ' 39' ' ' LEU . 34.0 p -70.22 -38.59 75.28 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.023 0.44 . . . . 0.0 110.969 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.667 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 11.9 m-85 -78.45 -34.0 48.05 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.849 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.58 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -57.04 -47.14 81.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.009 0.909 . . . . 0.0 108.711 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.8 t -70.26 -54.39 18.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.291 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.64 ' HD2' ' CD1' ' A' ' 44' ' ' PHE . 27.3 t80 -76.4 -54.56 6.56 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -177.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.5 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.44 -37.49 65.83 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 113.956 -1.474 . . . . 0.0 114.422 -175.303 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.63 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 8.0 t -70.56 16.18 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.089 0.404 . . . . 0.0 111.79 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.527 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -48.69 153.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.483 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -60.17 5.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.527 ' H ' ' C ' ' A' ' 47' ' ' ALA . 55.3 m95 -90.06 -24.83 21.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.64 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 0.6 OUTLIER -69.23 -22.05 63.89 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.161 -179.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.483 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -69.09 -29.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.217 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -54.86 -42.88 72.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.628 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 164.76 30.65 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.066 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -120.98 97.01 5.33 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.855 0.836 . . . . 0.0 110.449 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 39.4 mt -75.14 -18.91 60.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.182 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.89 -53.72 0.19 Allowed Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.593 ' HD3' ' HB2' ' A' ' 56' ' ' ALA . 81.0 Cg_exo -49.52 -45.18 32.09 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.537 1.492 . . . . 0.0 112.056 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.38 -49.78 37.42 Favored Glycine 0 CA--C 1.505 -0.59 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.474 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.12 88.81 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.871 -0.665 . . . . 0.0 111.219 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.476 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.78 -36.84 84.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.241 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.61 ' HD2' ' CD1' ' A' ' 61' ' ' TYR . 2.5 m-85 -72.14 -43.87 63.99 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.765 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.3 87.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.893 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.637 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -71.46 -55.01 8.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.61 ' HD2' ' CD1' ' A' ' 64' ' ' TYR . 0.8 OUTLIER -77.81 -24.16 48.85 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.44 -31.25 46.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 119.984 -1.103 . . . . 0.0 111.68 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -91.67 -26.47 5.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.639 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.64 -50.57 71.99 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.862 178.588 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.776 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 41.6 Cg_endo -64.79 -39.83 24.43 Favored 'Trans proline' 0 N--CA 1.448 -1.167 0 C-N-CA 122.978 2.452 . . . . 0.0 112.262 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.55 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.983 0.42 . . . . 0.0 110.339 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' HD22 ' A' ' 74' ' ' LEU . 63.2 mt -58.53 -53.83 53.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.096 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.9 mt -49.58 -51.67 35.52 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.347 0.404 . . . . 0.0 112.089 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.1 tt -58.2 -43.9 87.82 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 78.5 mt -70.99 -39.12 72.64 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -81.74 -23.2 36.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 110.353 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.524 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -89.83 -7.14 55.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.474 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tp . . . . . 0 N--CA 1.456 -0.168 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.225 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo . . . . . 0 C--O 1.231 0.136 0 CA-C-O 120.854 0.272 . . . . 0.0 112.296 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.02 -47.52 68.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.656 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 86.2 t80 -64.95 -42.43 94.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.91 -30.98 72.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.966 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.8 -44.14 64.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.021 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.0 mtt -65.8 -33.91 76.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.738 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.62 -42.3 95.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.579 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.667 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 66.9 t80 -58.66 -44.54 90.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.379 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.7 -37.38 86.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.235 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -66.44 -30.29 70.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.603 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -74.25 -32.28 62.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.665 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -76.24 -39.59 54.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -70.22 -31.91 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.08 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -71.49 -37.95 71.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.855 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.49 -40.72 85.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -49.2 74.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.806 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 12.0 pt-20 -64.44 -39.73 94.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.748 0.308 . . . . 0.0 111.729 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.538 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.4 m-20 -63.2 -53.66 49.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.949 0.404 . . . . 0.0 110.695 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.3 mt -49.05 -56.06 10.18 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.453 HG21 ' N ' ' A' ' 26' ' ' VAL . 33.5 m -53.09 -45.96 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.453 ' N ' HG21 ' A' ' 25' ' ' VAL . 27.8 m -74.4 -35.98 40.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.146 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 91.2 mt -66.99 -23.08 65.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.049 0.452 . . . . 0.0 109.906 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.25 -31.02 69.28 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.697 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.06 -31.6 64.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.214 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.59 74.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -65.22 -42.18 93.71 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.241 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.697 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.4 p -62.46 -39.65 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.6 -43.69 97.12 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.393 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.27 -49.57 76.29 Favored Glycine 0 C--N 1.332 0.331 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.559 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.05 -21.68 66.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.047 -0.576 . . . . 0.0 110.279 178.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -74.59 -32.67 62.44 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.56 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.89 59.63 Favored Glycine 0 N--CA 1.433 -1.511 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.747 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.559 HG23 ' HA ' ' A' ' 35' ' ' ALA . 14.3 tt -77.45 -36.35 23.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.492 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.658 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.72 -38.75 58.29 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.658 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.9 -38.35 79.55 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -178.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 12.3 m-85 -77.84 -34.69 51.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.556 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.67 -47.23 80.26 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.933 0.873 . . . . 0.0 108.843 176.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.16 -54.21 19.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.816 -1.083 . . . . 0.0 112.266 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -76.88 -54.38 6.67 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.959 1.837 . . . . 0.0 115.959 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.529 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.02 -45.63 56.62 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 113.951 -1.477 . . . . 0.0 114.48 -175.44 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.466 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 24.9 t -55.95 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.477 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 49.73 -147.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.509 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.46 12.62 10.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.824 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -91.05 -29.6 17.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.892 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.601 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -69.01 -22.31 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.518 -179.098 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.7 pt -66.81 -29.7 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -54.83 -35.93 64.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.38 31.72 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.078 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.2 ttm180 -122.87 98.85 6.09 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.714 0.769 . . . . 0.0 110.208 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 58' ' ' GLY . 72.9 mt -75.19 -20.0 59.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.724 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -26.44 -54.49 0.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.614 ' HD3' ' HB2' ' A' ' 56' ' ' ALA . 75.4 Cg_exo -52.02 -45.44 38.83 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.562 1.508 . . . . 0.0 111.972 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -48.02 46.03 Favored Glycine 0 CA--C 1.504 -0.595 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.4 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -36.94 85.76 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.967 -0.617 . . . . 0.0 111.444 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -64.66 -35.07 79.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.177 0.513 . . . . 0.0 109.968 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.593 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.76 -48.98 33.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.086 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.914 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.671 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.3 t80 -71.27 -55.42 8.09 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.759 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.89 -23.96 48.57 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.692 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.09 -30.56 46.18 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.174 -1.012 . . . . 0.0 111.658 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.422 HG23 HD21 ' A' ' 70' ' ' LEU . 1.7 p -90.26 -29.94 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.671 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.93 -52.44 46.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.153 179.058 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.759 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.1 Cg_endo -64.61 -40.06 24.82 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 123.053 2.502 . . . . 0.0 112.441 -178.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -56.71 18.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.533 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.422 HD21 HG23 ' A' ' 66' ' ' VAL . 4.5 mm? -58.61 -53.27 60.2 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.622 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.4 mt -49.48 -51.8 33.59 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 tp -58.28 -45.58 87.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.87 -38.05 76.29 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.48 -20.0 37.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.093 0.473 . . . . 0.0 110.426 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.422 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -94.37 -7.24 42.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.767 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.8 tp . . . . . 0 CA--C 1.532 0.28 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.131 179.402 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo . . . . . 0 C--O 1.231 0.137 0 CA-C-O 120.707 0.211 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.72 -53.52 46.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.64 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 89.6 t80 -64.08 -41.69 97.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.996 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.14 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.32 68.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.384 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.0 mtp -68.33 -30.13 69.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.35 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.09 -46.75 70.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.338 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.34 -37.61 83.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.883 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -68.51 -44.69 74.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.57 -43.47 98.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.757 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.64 -28.67 69.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.452 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -74.93 -41.73 59.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.641 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -67.83 -34.61 77.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.72 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.16 -33.58 74.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -69.11 -54.26 15.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.025 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.457 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.32 -40.89 68.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.681 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.457 ' N ' HD21 ' A' ' 21' ' ' LEU . 11.2 pt-20 -71.77 -32.49 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.779 0.323 . . . . 0.0 111.163 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.57 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 84.2 m-20 -66.96 -54.49 21.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.945 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.0 mt -53.46 -51.28 63.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.41 HG21 ' N ' ' A' ' 26' ' ' VAL . 27.7 m -52.77 -46.11 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' N ' HG21 ' A' ' 25' ' ' VAL . 9.6 p -75.73 -37.15 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.849 0.357 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 97.0 mt -66.96 -22.67 65.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.017 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.54 -29.86 68.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.56 -33.16 64.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.366 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -42.79 75.1 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.5 t -65.49 -40.61 93.26 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.088 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.623 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.25 -40.67 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.541 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.43 -42.57 96.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.271 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.441 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.85 -49.6 74.23 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.561 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -67.48 -19.63 65.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.045 -0.577 . . . . 0.0 110.509 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.528 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -77.74 -31.65 52.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.606 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.3 -32.14 58.43 Favored Glycine 0 N--CA 1.432 -1.573 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.41 178.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.592 ' O ' HD11 ' A' ' 42' ' ' LEU . 13.9 tt -78.05 -36.09 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.393 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.67 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.37 -35.92 54.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.67 ' N ' HD13 ' A' ' 39' ' ' LEU . 56.4 p -71.38 -35.17 70.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.189 0.519 . . . . 0.0 110.5 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.669 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 18.1 m-30 -79.49 -35.36 40.31 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.279 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.592 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -55.86 -46.72 78.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.765 0.793 . . . . 0.0 108.924 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.416 HG21 ' N ' ' A' ' 44' ' ' PHE . 35.0 m -72.42 -46.16 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.243 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 44' ' ' PHE . 1.8 m-85 -76.59 -53.91 7.4 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 45' ' ' PHE . 9.3 m-85 -77.84 -48.7 15.86 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.483 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -54.44 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.233 -174.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.79 -145.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 8.31 9.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.941 0.401 . . . . 0.0 110.496 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.9 m95 -91.28 -26.76 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.651 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 1.4 p90 -63.8 -34.12 77.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.568 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.4 pt -56.49 -26.97 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -52.48 -48.73 65.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.235 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 173.15 49.76 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.073 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.8 ptt180 -156.21 102.02 2.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.535 0.683 . . . . 0.0 111.856 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' A' ' 56' ' ' ALA . 38.7 mt -73.91 -18.23 60.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.207 178.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.566 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.23 -53.79 0.17 Allowed Pre-proline 0 N--CA 1.463 0.224 0 O-C-N 123.691 0.619 . . . . 0.0 112.388 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.727 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 83.7 Cg_exo -47.61 -51.12 10.22 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.271 1.314 . . . . 0.0 111.87 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.62 -50.0 26.08 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 115.858 -0.61 . . . . 0.0 113.694 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.83 96.37 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.191 -0.504 . . . . 0.0 111.847 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.408 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -60.42 -34.08 73.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.632 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -75.03 -51.62 13.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.523 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.32 79.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.589 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.695 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.3 t80 -71.29 -55.28 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.533 -178.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.63 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.4 OUTLIER -77.71 -23.82 49.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -80.27 -29.78 44.0 Favored Glycine 0 N--CA 1.454 -0.142 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.616 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.29 -30.29 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.695 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.69 -51.29 61.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.314 179.208 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.782 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 48.2 Cg_endo -64.94 -39.75 23.57 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 122.814 2.343 . . . . 0.0 111.992 -178.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 73' ' ' LEU . 1.5 tm? -57.56 -57.51 12.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.123 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' HD22 ' A' ' 74' ' ' LEU . 4.4 mm? -57.09 -52.03 66.92 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.432 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.03 -50.96 45.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.28 -45.57 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.533 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 69' ' ' LEU . 10.8 mp -71.34 -37.88 71.68 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -81.48 -23.58 37.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.01 0.433 . . . . 0.0 110.263 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.0 -6.04 56.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.336 0.589 . . . . 0.0 109.613 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.8 tp . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.003 179.338 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo . . . . . 0 CA--C 1.526 0.113 0 CA-C-O 120.74 0.225 . . . . 0.0 112.609 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.42 -43.27 86.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.017 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.607 ' HD1' ' CD2' ' A' ' 8' ' ' PHE . 42.7 t80 -70.93 -40.31 72.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.992 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.8 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.368 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.78 -34.76 69.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.173 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.3 tpp -67.62 -41.24 84.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.42 -32.09 73.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.133 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.602 ' HD1' ' CD2' ' A' ' 13' ' ' TYR . 78.0 t80 -66.55 -48.1 70.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.909 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.71 -44.13 96.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.797 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.06 -32.83 74.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . 0.439 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.5 t70 -68.24 -37.64 81.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.459 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.86 -31.06 59.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.97 -43.85 70.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.439 ' NZ ' ' HA ' ' A' ' 16' ' ' ASP . 9.2 ptpp? -65.55 -32.91 74.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.748 0.309 . . . . 0.0 111.021 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.38 -51.26 54.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.452 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.68 -47.1 77.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.902 -179.733 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.452 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.6 pt-20 -66.55 -37.16 84.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.749 0.309 . . . . 0.0 111.671 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.443 ' O ' HD11 ' A' ' 27' ' ' LEU . 5.8 m-20 -65.22 -43.52 91.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.237 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.56 -54.89 39.95 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.411 HG21 ' N ' ' A' ' 26' ' ' VAL . 30.2 m -52.39 -45.41 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -177.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.558 HG12 HD11 ' A' ' 27' ' ' LEU . 7.4 p -74.51 -38.18 45.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 120.679 0.276 . . . . 0.0 110.806 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.558 HD11 HG12 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -63.66 -24.54 67.83 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.35 -32.57 73.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.638 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.59 -32.12 67.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.354 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -45.12 69.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.46 0.648 . . . . 0.0 109.367 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 58.1 m -64.43 -39.44 93.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.31 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.638 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.89 -41.68 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.052 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.507 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.59 -43.48 93.67 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 178.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.444 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -61.49 -49.53 76.1 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.55 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.94 -21.84 66.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.429 178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.529 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.4 m-70 -76.29 -31.97 58.52 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.65 -32.58 59.23 Favored Glycine 0 N--CA 1.434 -1.461 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.898 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.6 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.1 tt -78.44 -36.51 20.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.363 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.684 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.03 -35.73 59.39 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.684 ' N ' HD13 ' A' ' 39' ' ' LEU . 36.1 p -69.78 -40.49 76.01 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.963 0.411 . . . . 0.0 110.881 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.668 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 12.5 m-85 -76.53 -33.45 58.58 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.803 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.6 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.5 -46.89 83.23 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.943 0.878 . . . . 0.0 108.852 176.305 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 97.9 t -70.27 -54.35 19.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.112 -179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -76.25 -54.45 6.78 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.859 1.799 . . . . 0.0 115.859 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.609 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.98 -45.56 49.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.833 -1.53 . . . . 0.0 114.458 -175.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.642 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 18.1 t -58.63 -81.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.402 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 46.8 -147.33 0.17 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -117.64 10.63 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.963 0.411 . . . . 0.0 110.263 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -91.05 -24.99 19.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.306 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.611 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 1.4 p90 -68.97 -32.96 72.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.291 -179.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 pt -63.29 -28.03 44.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 110.618 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -53.84 -52.15 61.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.025 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.76 44.28 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.112 -1.042 . . . . 0.0 113.275 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 7.4 ptp180 -151.67 99.1 2.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.719 0.771 . . . . 0.0 111.45 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 58' ' ' GLY . 0.0 OUTLIER -72.48 -18.01 61.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.212 179.37 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.55 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.37 -52.77 0.17 Allowed Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -178.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.55 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 83.1 Cg_exo -48.76 -44.56 31.05 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.372 1.381 . . . . 0.0 112.173 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -47.75 47.35 Favored Glycine 0 CA--C 1.504 -0.597 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.274 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.31 90.6 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.846 -0.677 . . . . 0.0 111.308 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.478 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.79 -34.16 76.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.275 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.642 ' HH ' ' HB2' ' A' ' 46' ' ' CYS . 2.5 m-85 -75.31 -44.35 45.94 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.007 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.66 -39.19 88.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 1.625 ' HD2' ' CD1' ' A' ' 63' ' ' PHE . 8.9 m-85 -71.3 -54.7 9.94 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.765 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.71 -23.94 49.34 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.726 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.36 42.74 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 119.957 -1.116 . . . . 0.0 111.648 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.87 -26.11 5.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.645 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.55 -51.32 70.64 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.663 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 37.9 Cg_endo -63.19 -41.31 28.23 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 123.209 2.606 . . . . 0.0 112.256 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.411 HD11 HD11 ' A' ' 73' ' ' LEU . 1.4 tm? -56.68 -56.8 16.79 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' HD22 ' A' ' 74' ' ' LEU . 4.5 mm? -57.32 -52.41 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.699 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.9 mt -49.65 -52.99 26.94 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.54 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 31.4 tp -56.77 -45.34 82.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.411 HD11 HD11 ' A' ' 69' ' ' LEU . 11.1 mp -71.01 -38.6 72.64 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.402 HD22 ' O ' ' A' ' 70' ' ' LEU . 2.1 pp -81.46 -22.88 37.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.039 0.447 . . . . 0.0 110.436 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.48 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -92.18 -8.02 46.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.997 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.4 tp . . . . . 0 C--O 1.231 0.11 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.47 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.993 0.33 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.52 -33.74 76.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.452 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.67 ' HD1' ' CD2' ' A' ' 8' ' ' PHE . 90.3 t80 -75.6 -35.98 60.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.602 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -30.54 63.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.69 -46.22 47.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.8 ptm -63.84 -31.8 73.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.82 -36.08 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.633 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 88.9 t80 -67.0 -34.31 77.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.576 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -70.09 -46.54 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -66.24 -33.96 76.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.947 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.49 -48.48 64.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.0 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.61 -35.2 80.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -69.72 -39.38 76.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.258 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -68.37 -37.01 80.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.081 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.71 -53.14 45.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.078 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -48.57 70.39 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.692 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.92 -31.26 72.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.944 0.402 . . . . 0.0 110.996 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.427 ' O ' HD11 ' A' ' 27' ' ' LEU . 89.2 m-20 -67.64 -42.6 82.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.14 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -61.63 -50.91 70.65 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.42 HG21 ' N ' ' A' ' 26' ' ' VAL . 35.0 m -54.75 -41.74 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.917 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.42 ' N ' HG21 ' A' ' 25' ' ' VAL . 57.5 t -74.79 -41.8 47.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.746 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.5 HD22 ' O ' ' A' ' 75' ' ' ALA . 0.6 OUTLIER -64.63 -20.6 66.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.372 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -70.89 -37.03 72.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.622 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.16 -32.4 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.801 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -45.6 68.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.232 0.539 . . . . 0.0 109.581 177.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 96.1 p -64.14 -38.2 90.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.2 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.622 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.61 -41.36 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.527 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.7 -42.81 93.84 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.425 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' O ' ' HB3' ' A' ' 64' ' ' TYR . . . -61.94 -49.38 76.13 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 178.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.566 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -66.03 -20.7 66.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.063 -0.569 . . . . 0.0 110.281 178.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.529 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.6 m-70 -75.76 -31.75 59.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.12 -32.61 58.24 Favored Glycine 0 N--CA 1.434 -1.494 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.62 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.598 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.7 tt -77.86 -36.72 22.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.318 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.652 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.83 -37.78 58.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.652 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.15 -38.28 78.7 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.922 0.391 . . . . 0.0 111.187 -178.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.475 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 11.4 m-85 -77.9 -33.61 51.84 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.418 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.1 mp -57.27 -47.37 81.62 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.8 t -70.16 -54.06 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.234 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -76.23 -54.12 7.25 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.609 ' HD2' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -74.84 -40.22 61.16 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 113.98 -1.464 . . . . 0.0 114.817 -175.197 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.429 ' SG ' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -67.95 9.28 0.31 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.282 0.492 . . . . 0.0 112.192 -178.549 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -43.92 153.52 0.13 Allowed 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 178.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.34 6.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.51 ' H ' ' C ' ' A' ' 47' ' ' ALA . 26.4 m95 -90.78 -23.11 20.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.723 0.297 . . . . 0.0 110.899 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -69.04 -22.41 64.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.176 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.5 pt -70.1 -29.41 39.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 0.0 110.99 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -54.74 -33.68 61.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.874 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.58 29.39 0.03 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.519 -0.848 . . . . 0.0 113.307 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.418 ' O ' ' CG ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -124.28 97.65 5.42 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.711 0.767 . . . . 0.0 110.583 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 58' ' ' GLY . 36.1 mt -74.56 -19.23 60.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.135 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.59 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.57 -53.63 0.18 Allowed Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -178.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.624 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 85.8 Cg_exo -48.77 -46.43 24.53 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.417 1.411 . . . . 0.0 111.987 178.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.35 -48.0 42.03 Favored Glycine 0 CA--C 1.506 -0.508 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.528 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.22 93.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.923 -0.638 . . . . 0.0 111.31 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.475 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.49 -34.91 77.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.131 0.491 . . . . 0.0 109.976 179.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.624 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.0 m-85 -73.89 -42.84 60.11 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.767 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.95 85.52 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.796 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.49 -55.1 8.54 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.594 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 1.6 m-85 -77.86 -24.22 48.63 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.98 -31.01 44.78 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.948 -1.12 . . . . 0.0 111.609 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.02 -27.88 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.115 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.641 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -49.39 -51.16 60.38 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.974 178.477 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.778 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.9 Cg_endo -64.4 -40.43 24.66 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 123.053 2.502 . . . . 0.0 112.232 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.471 HD11 HD11 ' A' ' 73' ' ' LEU . 1.8 tm? -57.6 -55.52 33.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' HD22 ' A' ' 74' ' ' LEU . 49.4 mt -55.58 -53.6 54.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.161 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -49.68 -52.53 30.35 Favored 'General case' 0 C--O 1.223 -0.31 0 O-C-N 123.403 0.439 . . . . 0.0 112.091 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 62.6 tp -57.39 -44.53 84.57 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.471 HD11 HD11 ' A' ' 69' ' ' LEU . 11.0 mp -71.42 -39.74 70.89 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.33 -23.97 37.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.379 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.5 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -90.48 -7.36 53.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.722 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.8 tp . . . . . 0 C--O 1.231 0.117 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.355 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.815 0.256 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.56 -34.61 78.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.765 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -75.94 -40.44 54.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.12 83.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.13 64.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 47.3 ttm -72.13 -43.48 64.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.981 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -63.87 -37.87 88.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.634 ' HD2' ' CD1' ' A' ' 13' ' ' TYR . 69.8 t80 -59.94 -50.86 72.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -59.46 -38.18 80.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.699 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -66.32 -39.79 89.51 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.058 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -66.06 -41.96 90.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -70.67 -32.78 70.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.73 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.457 ' HA ' HD21 ' A' ' 21' ' ' LEU . 24.1 t70 -68.5 -40.29 80.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.431 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -68.48 -28.86 67.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.443 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -53.18 36.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.328 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.631 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.5 pp -59.31 -42.56 91.65 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.198 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.631 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -67.36 -42.98 82.58 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.357 -176.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.557 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.4 m-20 -63.14 -54.9 30.56 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.383 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.8 tp -51.95 -52.18 52.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.8 t -50.12 -49.85 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.1 t -72.57 -40.36 62.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.14 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 92.6 mt -63.68 -21.82 66.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.396 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.68 -31.08 67.85 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.636 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.89 -34.44 69.17 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.267 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.68 79.35 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -66.54 -39.89 88.81 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.157 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.636 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -65.57 -39.77 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.502 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.38 -43.06 96.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.166 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.78 -49.24 78.09 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.598 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.3 -23.07 66.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.255 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.528 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.8 m-70 -75.27 -31.97 60.91 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.83 -33.57 60.02 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.999 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.598 HG23 ' HA ' ' A' ' 35' ' ' ALA . 16.8 tt -78.52 -36.55 20.23 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.452 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.659 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.09 -35.85 59.18 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.659 ' N ' HD13 ' A' ' 39' ' ' LEU . 35.5 p -69.54 -39.69 77.33 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.014 0.435 . . . . 0.0 110.957 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.67 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 12.8 m-85 -77.93 -32.33 51.53 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.595 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.3 -47.11 82.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.063 0.935 . . . . 0.0 108.565 176.22 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.4 t -70.05 -54.35 19.29 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.727 0 CA-C-N 114.691 -1.14 . . . . 0.0 112.074 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -77.2 -54.76 6.1 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.502 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -72.1 -38.29 69.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.839 -1.528 . . . . 0.0 114.374 -175.317 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.66 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 8.9 t -69.54 15.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.025 0.375 . . . . 0.0 111.886 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.524 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.85 156.13 0.77 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.48 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.62 7.43 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.524 ' H ' ' C ' ' A' ' 47' ' ' ALA . 29.4 m95 -90.55 -23.99 20.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.899 0.381 . . . . 0.0 110.742 178.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -68.11 -25.14 65.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.392 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 48' ' ' ALA . 39.7 pt -71.33 -29.43 35.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.662 0.267 . . . . 0.0 111.246 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -55.86 -35.75 66.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.818 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.58 32.28 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.101 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -128.43 98.08 4.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.724 0.773 . . . . 0.0 110.653 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 3.8 pp -75.28 -19.14 59.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.937 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.35 -54.29 0.17 Allowed Pre-proline 0 N--CA 1.467 0.381 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.584 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 88.6 Cg_exo -48.43 -45.23 27.5 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.321 1.347 . . . . 0.0 111.749 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.93 -48.49 45.21 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 115.752 -0.658 . . . . 0.0 113.276 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.13 -36.14 83.06 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.587 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -65.11 -35.57 81.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.189 0.519 . . . . 0.0 110.071 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.618 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 2.9 m-85 -72.82 -49.0 33.05 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.997 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.22 90.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.681 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.1 t80 -70.97 -55.26 8.72 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.596 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -77.7 -24.19 49.28 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.11 -30.49 46.4 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.639 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.421 HG21 HD11 ' A' ' 70' ' ' LEU . 1.8 p -90.16 -29.65 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.137 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.681 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.28 -51.87 53.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.247 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.755 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.5 Cg_endo -64.89 -40.2 22.19 Favored 'Trans proline' 0 N--CA 1.448 -1.166 0 C-N-CA 123.015 2.476 . . . . 0.0 112.323 -178.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.08 -54.63 44.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 0.0 110.545 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.421 HD11 HG21 ' A' ' 66' ' ' VAL . 11.1 mp -57.37 -53.66 55.59 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.368 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.1 mt -50.64 -49.33 57.2 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.251 0.344 . . . . 0.0 111.8 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 45.9 tp -60.05 -43.21 95.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.7 mt -71.91 -38.55 69.89 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -82.16 -21.41 36.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.985 0.421 . . . . 0.0 110.311 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.416 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -92.13 -3.88 55.06 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.373 0.606 . . . . 0.0 109.779 178.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 1.5 tp . . . . . 0 CA--C 1.528 0.099 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.964 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 C--O 1.232 0.179 0 N-CA-C 112.686 0.226 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.03 -57.61 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.363 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -65.88 -31.41 72.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.276 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.94 -46.14 68.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.203 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.87 -37.15 86.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -67.16 -28.59 68.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.6 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -67.42 -40.2 85.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -65.04 -31.75 73.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -50.68 39.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.835 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.15 -28.94 69.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.02 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.56 -48.65 54.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.03 -34.51 76.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.097 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -67.79 -46.56 71.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.168 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.561 ' HZ1' HD22 ' A' ' 23' ' ' ASN . 60.5 tttm -62.38 -38.25 88.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.557 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -64.81 -50.67 65.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.154 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.431 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.0 -48.78 70.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.635 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.431 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.5 pt-20 -65.04 -31.23 72.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.561 HD22 ' HZ1' ' A' ' 19' ' ' LYS . 93.3 m-20 -65.78 -46.38 78.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.339 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -60.94 -52.44 65.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 m -53.57 -42.6 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.254 -177.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.28 -41.76 43.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.382 . . . . 0.0 110.915 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.549 HD22 ' O ' ' A' ' 75' ' ' ALA . 0.7 OUTLIER -64.25 -21.93 66.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.4 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -70.07 -30.66 67.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.63 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -74.59 -34.4 62.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.66 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.19 -42.73 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.281 0.562 . . . . 0.0 109.525 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.0 t -65.39 -41.43 93.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -62.54 -41.09 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.086 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.512 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.97 -42.06 97.59 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.455 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.27 -50.17 67.53 Favored Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.558 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.23 -20.1 65.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.113 -0.543 . . . . 0.0 110.184 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.527 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.3 m-70 -76.48 -32.27 58.25 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.32 -33.09 59.3 Favored Glycine 0 N--CA 1.43 -1.7 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.429 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.588 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.2 tt -77.08 -37.2 25.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.468 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.648 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.82 -37.24 59.27 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.648 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -72.71 -33.43 66.44 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.919 0.39 . . . . 0.0 110.853 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.632 ' HE2' ' CE1' ' A' ' 41' ' ' PHE . 14.7 m-85 -79.7 -35.06 39.61 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.822 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.588 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.26 -45.83 79.89 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.747 0.784 . . . . 0.0 108.923 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.8 m -72.59 -45.47 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.168 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 0.479 ' HB2' ' O ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -76.15 -54.0 7.46 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.208 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.722 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 8.7 m-85 -78.68 -49.08 13.77 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.494 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -57.07 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.516 -0.874 . . . . 0.0 111.562 -175.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' CYS . . . 38.27 -139.51 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.88 18.75 10.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.956 0.408 . . . . 0.0 110.561 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -90.37 -37.15 14.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.824 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CB ' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.17 -15.24 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.069 -179.484 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -58.62 -28.87 37.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.865 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -54.45 -29.96 51.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.821 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.73 26.08 0.3 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.479 -0.867 . . . . 0.0 113.357 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.5 OUTLIER -110.97 105.74 14.62 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.263 0.554 . . . . 0.0 110.244 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 56' ' ' ALA . 50.8 mt -74.31 -18.87 60.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.16 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.555 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.47 -52.17 0.17 Allowed Pre-proline 0 N--CA 1.468 0.428 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.722 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 88.1 Cg_exo -49.88 -49.67 15.39 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 121.728 1.618 . . . . 0.0 112.055 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.41 -49.36 26.25 Favored Glycine 0 CA--C 1.506 -0.503 0 CA-C-N 115.943 -0.572 . . . . 0.0 114.014 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.32 99.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.171 -0.515 . . . . 0.0 111.734 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.459 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.5 -34.84 73.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.24 0.543 . . . . 0.0 110.164 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.639 ' HE1' ' CE2' ' A' ' 61' ' ' TYR . 3.6 m-30 -74.39 -44.36 52.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.169 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.17 86.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.673 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.601 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.1 m-85 -71.4 -54.77 9.61 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -77.73 -24.19 49.16 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.414 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -78.62 -31.42 45.21 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.605 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 p -91.8 -24.69 5.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.646 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.82 -50.53 77.28 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.714 178.297 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.0 Cg_endo -63.62 -39.75 33.62 Favored 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.923 2.415 . . . . 0.0 111.882 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.41 -58.15 9.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.185 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.411 ' O ' HD22 ' A' ' 74' ' ' LEU . 10.8 mp -55.29 -52.84 62.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.451 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.7 mt -49.78 -52.54 31.18 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.327 0.392 . . . . 0.0 112.041 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 46.9 tp -56.83 -45.41 82.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.717 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.47 -38.98 74.51 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.411 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.02 -20.9 37.44 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.049 0.452 . . . . 0.0 110.452 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.549 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -93.55 -12.07 30.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.4 tp . . . . . 0 N--CA 1.456 -0.164 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.322 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.762 0.234 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.22 -44.4 95.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.82 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.654 ' HE2' ' CE1' ' A' ' 8' ' ' PHE . 82.5 t80 -67.6 -31.37 71.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.848 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.91 -38.41 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.156 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.41 -41.75 84.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.028 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 95.6 mmm -66.05 -34.28 77.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -62.67 -37.84 88.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.648 ' HE2' ' CE1' ' A' ' 13' ' ' TYR . 76.1 t80 -65.6 -36.04 82.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -69.71 -48.02 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.999 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -66.13 -32.22 73.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.968 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.71 -49.49 52.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.57 -34.11 77.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.69 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.492 ' HA ' HD21 ' A' ' 21' ' ' LEU . 21.9 t70 -64.45 -49.86 69.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.56 -28.61 69.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.783 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.545 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.11 -56.68 8.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.555 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.681 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.2 pp -54.93 -43.97 73.81 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.508 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.681 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 12.8 pt-20 -67.35 -34.01 76.44 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -177.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.492 ' O ' HD12 ' A' ' 27' ' ' LEU . 10.5 m120 -67.71 -54.79 16.56 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.96 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.8 mt -53.52 -49.95 66.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.463 HG11 ' O ' ' A' ' 21' ' ' LEU . 19.6 m -53.68 -42.04 49.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -177.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.589 HG11 HD11 ' A' ' 27' ' ' LEU . 7.2 p -82.02 -39.13 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.425 0.155 . . . . 0.0 111.369 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.589 HD11 HG11 ' A' ' 26' ' ' VAL . 10.4 mp -61.69 -27.86 69.0 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.77 -38.11 82.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.925 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.65 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -68.5 -31.91 71.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.739 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.491 ' HB3' HD11 ' A' ' 71' ' ' LEU . . . -69.69 -42.38 74.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.342 0.592 . . . . 0.0 109.7 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.417 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 34.0 t -67.42 -36.64 81.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.315 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.65 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -67.82 -44.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.075 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.45 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.86 -44.1 97.47 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.838 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.411 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.92 -49.62 73.79 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.314 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.542 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -66.72 -20.29 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.276 -0.462 . . . . 0.0 110.208 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.504 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.6 m-70 -76.12 -32.24 59.06 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -33.05 58.71 Favored Glycine 0 N--CA 1.435 -1.425 0 CA-C-N 114.265 -1.334 . . . . 0.0 110.854 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.553 ' O ' HD21 ' A' ' 42' ' ' LEU . 14.5 tt -77.4 -37.44 25.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.383 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.637 HD13 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.58 -38.1 59.4 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.637 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.2 -37.78 78.29 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 120.804 0.335 . . . . 0.0 110.982 -178.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.458 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 11.7 m-85 -78.21 -32.69 50.02 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.515 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.553 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -58.1 -46.79 84.93 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 176.262 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.4 t -69.93 -53.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.047 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.657 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 8.6 m-85 -76.11 -54.91 6.13 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -177.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.624 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -74.78 -45.42 43.79 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.828 -1.533 . . . . 0.0 114.48 -175.236 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.503 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.46 -81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.122 0.419 . . . . 0.0 111.615 -178.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 50.35 -146.39 0.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.03 9.08 9.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.092 0.472 . . . . 0.0 110.616 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -91.13 -26.53 19.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.208 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 1.585 ' HE2' ' CE1' ' A' ' 50' ' ' TYR . 1.1 p90 -67.74 -23.39 65.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.455 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 48' ' ' ALA . 32.3 pt -70.66 -28.5 34.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.884 0.373 . . . . 0.0 110.702 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.58 ' HZ1' ' HB3' ' A' ' 52' ' ' LYS . 5.3 ttpm? -54.08 -29.55 44.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.913 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.26 37.53 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.594 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.514 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -133.96 97.79 3.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.817 0.818 . . . . 0.0 110.731 -179.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.61 -19.78 58.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.452 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -26.31 -54.68 0.2 Allowed Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.598 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 71.0 Cg_exo -50.43 -43.38 44.72 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 121.645 1.563 . . . . 0.0 112.037 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.47 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.8 -46.3 48.6 Favored Glycine 0 CA--C 1.507 -0.467 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.364 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.23 86.11 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.519 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.458 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -65.88 -31.07 71.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.598 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.8 m-30 -77.15 -45.23 27.48 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.926 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.93 -38.95 87.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.716 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 1.669 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 18.6 t80 -71.18 -55.04 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 1.634 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -77.9 -23.34 48.72 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.54 -28.99 50.48 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 119.867 -1.159 . . . . 0.0 111.652 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -91.66 -30.12 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.662 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.32 -49.84 68.26 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.992 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.1 Cg_endo -64.83 -39.09 27.07 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.93 2.42 . . . . 0.0 112.01 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.14 -54.81 42.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.437 ' O ' HD22 ' A' ' 74' ' ' LEU . 4.6 mm? -56.52 -50.8 70.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.767 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 30' ' ' ALA . 72.0 mt -51.0 -51.09 56.49 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.351 0.407 . . . . 0.0 111.977 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.58 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 8.8 tt -59.99 -40.4 89.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.684 0.278 . . . . 0.0 111.487 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.2 tp -73.62 -40.52 63.73 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.1 pp -80.14 -28.47 38.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.594 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.504 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -86.34 -3.1 58.93 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.263 0.554 . . . . 0.0 109.518 178.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.4 tp . . . . . 0 C--O 1.232 0.168 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.092 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo . . . . . 0 N--CA 1.472 0.247 0 N-CA-C 113.12 0.392 . . . . 0.0 113.12 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.19 -38.1 82.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.702 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -75.09 -39.26 60.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.767 0.317 . . . . 0.0 111.163 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.87 -41.38 95.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.4 -37.1 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.831 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.0 ttm -68.0 -34.18 76.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.94 -41.7 97.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 75.0 t80 -60.62 -36.34 78.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.315 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -69.41 -40.82 77.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.839 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -66.43 -46.64 75.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.192 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.14 -27.61 68.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.236 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.32 -43.2 33.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.941 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.47 -33.52 74.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -69.47 -38.29 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.573 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.26 -53.98 36.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.822 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -49.25 68.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.35 -31.53 72.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 0.0 111.057 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.572 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -66.43 -54.1 28.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.167 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 1.0 OUTLIER -53.58 -50.08 66.37 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.422 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.421 HG21 ' N ' ' A' ' 26' ' ' VAL . 35.5 m -53.83 -44.98 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.421 ' N ' HG21 ' A' ' 25' ' ' VAL . 27.5 m -76.28 -37.25 31.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.125 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 93.0 mt -66.83 -20.41 65.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.102 0.477 . . . . 0.0 109.889 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -70.79 -31.21 67.9 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.625 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.95 -33.78 66.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.251 178.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.48 -41.53 76.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.8 t -66.25 -40.53 90.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.083 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.625 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -63.39 -38.79 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.52 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.26 -41.39 96.85 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.31 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.467 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.73 71.57 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.574 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -66.96 -20.71 65.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.133 -0.533 . . . . 0.0 110.164 178.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.5 m-70 -74.94 -33.3 61.93 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.601 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.81 -33.3 60.32 Favored Glycine 0 N--CA 1.431 -1.673 0 CA-C-N 113.98 -1.464 . . . . 0.0 110.393 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.583 ' O ' HD11 ' A' ' 42' ' ' LEU . 13.1 tt -78.05 -35.59 20.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.695 -179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.636 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.8 -37.57 55.54 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.636 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -73.06 -33.24 65.55 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.851 0.358 . . . . 0.0 111.024 -179.107 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.467 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 15.5 m-30 -79.48 -35.39 40.3 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.927 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.583 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -56.36 -46.18 80.12 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.04 -46.11 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.1 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.663 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 1.5 m-85 -76.52 -54.37 6.8 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.715 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 11.1 m-85 -77.31 -48.78 16.49 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -176.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.486 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 49.0 t -56.05 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.763 -175.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 42.63 -143.42 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.96 12.83 9.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.549 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.58 ' HB3' HH21 ' A' ' 54' ' ' ARG . 25.8 m95 -90.66 -32.44 16.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.584 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.425 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -63.96 -11.7 30.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.818 0.342 . . . . 0.0 111.313 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.6 pt -65.25 -27.59 42.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.658 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -52.67 -43.26 65.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.179 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.43 38.74 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.254 -0.974 . . . . 0.0 112.997 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.58 HH21 ' HB3' ' A' ' 49' ' ' TRP . 16.0 ptt180 -132.29 102.4 5.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.508 0.671 . . . . 0.0 111.492 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 58' ' ' GLY . 35.0 mt -73.32 -17.48 61.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.048 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.522 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -24.98 -52.55 0.16 Allowed Pre-proline 0 N--CA 1.465 0.302 0 O-C-N 123.768 0.667 . . . . 0.0 112.52 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.715 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.8 Cg_exo -48.25 -51.16 10.59 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.35 1.367 . . . . 0.0 111.798 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.82 -49.17 29.1 Favored Glycine 0 CA--C 1.509 -0.34 0 CA-C-N 115.978 -0.556 . . . . 0.0 113.896 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.09 99.7 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.063 -0.568 . . . . 0.0 111.776 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.78 -35.22 74.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.279 0.562 . . . . 0.0 110.219 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 0.623 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.3 m-30 -73.45 -45.79 52.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.119 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.54 -38.32 89.29 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.8 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 1.665 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 10.5 m-85 -71.39 -54.49 10.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.781 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.69 -24.02 49.4 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . 0.481 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -78.99 -31.67 42.52 Favored Glycine 0 CA--C 1.516 0.147 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.481 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -89.93 -27.44 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.664 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.28 -51.75 60.41 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.95 178.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.781 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.7 Cg_endo -62.37 -42.95 25.05 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 123.157 2.571 . . . . 0.0 112.143 -178.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.17 -55.31 36.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.424 ' O ' HD22 ' A' ' 74' ' ' LEU . 88.2 mt -57.89 -55.3 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.399 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.61 HD13 ' N ' ' A' ' 72' ' ' LEU . 4.3 pp -55.16 -38.35 68.16 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.61 ' N ' HD13 ' A' ' 71' ' ' LEU . 47.6 tp -66.83 -44.42 81.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.688 0.28 . . . . 0.0 111.057 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -70.97 -36.65 72.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.53 -23.82 34.37 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.113 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.42 -5.82 57.08 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp . . . . . 0 C--O 1.232 0.177 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.919 179.316 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo . . . . . 0 C--O 1.231 0.17 0 N-CA-C 112.805 0.271 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.1 -50.97 62.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.32 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -71.04 -31.16 67.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.67 -40.16 76.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.372 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.87 72.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.176 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.58 -40.32 88.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -62.16 -32.12 72.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.776 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.624 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 61.5 t80 -67.48 -39.95 85.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.568 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -67.34 -40.61 85.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.644 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.41 -40.79 89.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -64.12 -40.62 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.396 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.89 -34.58 75.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.443 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.474 ' HA ' HD21 ' A' ' 21' ' ' LEU . 16.2 t70 -67.18 -40.92 86.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.558 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 19' ' ' LYS . 10.5 mtmp? -66.74 -28.89 68.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.429 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.517 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.09 -56.62 9.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.187 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . 0.603 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.7 pp -55.51 -39.89 71.07 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 120.835 0.35 . . . . 0.0 110.978 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.603 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -69.38 -40.89 77.15 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.453 -176.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.598 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 m-20 -65.7 -55.28 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.476 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 7.3 mt -52.41 -51.6 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.449 HG21 ' N ' ' A' ' 26' ' ' VAL . 26.7 m -52.53 -44.55 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.449 ' N ' HG21 ' A' ' 25' ' ' VAL . 62.4 t -76.34 -40.97 35.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.687 0.279 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 86.0 mt -63.9 -21.35 66.42 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.021 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -69.5 -32.96 72.16 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.679 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.33 -31.8 65.98 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.41 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.78 -44.0 71.02 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 38.6 t -65.05 -40.12 94.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.247 179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.679 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.05 -40.59 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.08 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.74 98.86 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.681 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.417 ' HA2' ' HD2' ' A' ' 64' ' ' TYR . . . -62.16 -49.6 73.34 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.558 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.4 -20.15 65.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.277 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.546 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 m-70 -76.57 -32.11 57.95 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -32.57 59.29 Favored Glycine 0 N--CA 1.434 -1.483 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.653 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.595 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.0 tt -77.68 -36.74 23.2 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.388 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.652 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.84 -37.62 58.84 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.652 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.88 -36.54 75.53 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 120.842 0.353 . . . . 0.0 111.061 -178.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 1.66 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 9.9 m-85 -79.53 -33.33 42.06 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.296 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.595 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.1 mp -57.65 -47.34 82.53 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.759 0.79 . . . . 0.0 108.986 176.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.1 m -72.49 -50.8 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.329 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.619 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 36.7 t80 -77.08 -54.25 6.77 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -177.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.639 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -74.02 -45.91 46.84 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 113.967 -1.469 . . . . 0.0 114.195 -175.666 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.522 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.8 t -60.04 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.197 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.72 -142.17 0.47 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.23 11.37 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.037 0.446 . . . . 0.0 110.564 178.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -90.92 -28.21 18.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.032 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.445 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 1.2 p90 -67.23 -24.64 65.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.4 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 20.2 pt -66.37 -27.45 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 0.0 110.61 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -53.52 -52.35 59.91 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.12 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 169.8 40.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.179 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 50' ' ' TYR . 19.8 ptp180 -144.18 101.46 3.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.595 0.712 . . . . 0.0 111.425 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.477 HD11 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -73.25 -17.96 61.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.094 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.573 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.24 -54.05 0.17 Allowed Pre-proline 0 N--CA 1.468 0.433 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.632 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 85.1 Cg_exo -47.84 -46.41 21.61 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.321 1.348 . . . . 0.0 111.774 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.39 -46.67 44.81 Favored Glycine 0 CA--C 1.507 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.496 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.8 94.92 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.939 -0.631 . . . . 0.0 111.542 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.483 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -63.14 -34.82 78.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.962 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.631 ' HE1' ' CE2' ' A' ' 61' ' ' TYR . 3.1 m-30 -72.85 -44.53 61.27 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.656 179.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.9 88.45 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.857 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.656 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 5.7 m-85 -71.22 -54.96 9.15 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -178.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.753 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.76 -24.23 49.03 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.09 43.63 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.017 -1.087 . . . . 0.0 111.64 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.58 -26.78 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.656 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.84 -52.38 57.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.007 178.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.753 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.9 Cg_endo -64.76 -40.66 21.26 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 123.02 2.48 . . . . 0.0 112.501 -177.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -55.65 32.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.199 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.438 ' O ' HD22 ' A' ' 74' ' ' LEU . 92.8 mt -56.6 -53.93 51.87 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.313 179.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.5 mt -49.99 -51.67 39.92 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.353 0.408 . . . . 0.0 111.839 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LEU . 65.1 tp -58.36 -46.83 85.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.32 -38.11 81.24 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.438 HD22 ' O ' ' A' ' 70' ' ' LEU . 2.1 pp -81.91 -21.91 37.1 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.126 0.489 . . . . 0.0 110.122 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.41 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -92.55 -5.76 51.01 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.596 178.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 72' ' ' LEU . 21.3 tp . . . . . 0 CA--C 1.53 0.185 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.186 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.472 0.236 0 N-CA-C 112.743 0.247 . . . . 0.0 112.743 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -63.16 -39.19 93.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . 1.657 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 90.0 t80 -75.25 -42.0 56.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.68 96.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.35 77.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.012 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.3 ttp -68.59 -32.65 72.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.55 -36.92 79.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.828 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . 1.661 ' HE2' ' CE1' ' A' ' 13' ' ' TYR . 86.8 t80 -65.35 -42.85 92.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.807 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -62.21 -48.73 78.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -65.34 -30.38 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.994 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -70.98 -33.72 70.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -79.28 -37.1 38.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -67.37 -36.78 82.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.753 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.17 -36.93 75.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.958 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.559 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.12 -52.24 56.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.992 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -48.88 69.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.548 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 25' ' ' VAL . 12.4 pt-20 -65.29 -30.74 71.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.774 0.321 . . . . 0.0 111.085 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' HD11 ' A' ' 27' ' ' LEU . 85.6 m-20 -65.45 -47.9 74.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.033 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 6.2 mt -58.36 -52.47 65.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.034 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.458 HG21 ' N ' ' A' ' 26' ' ' VAL . 34.1 m -52.62 -45.63 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.458 ' N ' HG21 ' A' ' 25' ' ' VAL . 40.8 t -73.92 -44.75 50.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.878 0.37 . . . . 0.0 110.889 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 75' ' ' ALA . 0.9 OUTLIER -61.24 -21.6 64.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.337 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -70.03 -32.69 70.97 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.659 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.83 -33.41 68.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.52 -0.763 . . . . 0.0 109.431 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.42 -41.3 76.55 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . 0.414 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.5 t -66.14 -38.73 88.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.141 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.659 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -66.65 -40.03 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.463 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.73 -42.46 97.36 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.306 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.418 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.54 -49.12 76.5 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.611 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.05 -22.24 66.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.984 -0.608 . . . . 0.0 110.023 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.518 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 m-70 -74.47 -33.14 62.8 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.571 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.16 -34.31 61.44 Favored Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 179.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.611 HG23 ' HA ' ' A' ' 35' ' ' ALA . 18.2 tt -78.05 -35.94 20.97 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.206 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.565 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.664 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.51 -38.61 59.33 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.664 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.45 -39.15 81.57 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.803 0.335 . . . . 0.0 111.2 -178.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 10.7 m-85 -77.37 -32.82 55.19 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.606 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.596 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -57.77 -46.75 84.12 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.413 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.96 -54.18 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.028 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -76.13 -54.35 6.96 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 -177.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 0.504 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.37 -38.24 60.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 113.959 -1.473 . . . . 0.0 114.501 -175.449 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.527 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.34 16.35 0.08 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.12 0.418 . . . . 0.0 111.904 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.516 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.97 156.73 0.71 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.53 7.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . 0.516 ' H ' ' C ' ' A' ' 47' ' ' ALA . 25.1 m95 -90.65 -24.43 20.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.679 0.276 . . . . 0.0 110.854 178.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -27.67 67.15 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.177 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 48' ' ' ALA . 44.4 pt -68.19 -28.9 42.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.741 0.305 . . . . 0.0 110.809 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -54.37 -34.98 62.29 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.677 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.85 30.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.408 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -127.11 98.85 5.46 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.752 0.787 . . . . 0.0 110.442 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.2 mm? -75.01 -18.89 60.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.778 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.582 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.25 -53.82 0.17 Allowed Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.582 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 87.0 Cg_exo -48.35 -44.88 28.24 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.639 1.559 . . . . 0.0 112.109 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.59 -47.61 44.82 Favored Glycine 0 CA--C 1.505 -0.555 0 CA-C-N 115.798 -0.637 . . . . 0.0 113.408 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.42 83.98 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.94 -0.63 . . . . 0.0 111.53 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -65.01 -32.73 74.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.162 0.506 . . . . 0.0 110.054 178.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.636 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 3.6 m-85 -76.15 -46.49 28.38 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.195 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.57 85.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.584 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.644 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.5 t80 -71.26 -55.65 7.65 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.76 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -78.15 -23.56 47.69 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.82 -30.21 48.77 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.605 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -91.27 -29.68 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.644 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.52 -50.82 56.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.929 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.76 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 39.0 Cg_endo -64.47 -39.77 27.13 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 123.02 2.48 . . . . 0.0 112.126 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tt -57.67 -54.8 42.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.426 ' O ' HD22 ' A' ' 74' ' ' LEU . 10.9 mp -57.69 -52.73 64.24 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.469 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.54 -50.86 52.24 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 49.9 tp -57.06 -44.73 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.614 0.245 . . . . 0.0 111.497 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 mt -71.29 -38.32 71.8 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.426 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.7 pp -82.5 -19.69 38.25 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 110.438 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.488 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -94.86 -8.58 36.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.3 tp . . . . . 0 C--O 1.231 0.111 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.55 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.686 0.203 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.22 -58.09 6.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.172 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -60.89 -43.73 98.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.94 -42.55 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.975 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.37 96.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.99 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.7 mtp -63.77 -31.64 72.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.774 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.45 -39.7 92.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -64.23 -48.2 76.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.292 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -58.8 -49.27 78.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.14 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -60.91 -33.84 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.17 -35.95 76.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -73.73 -34.83 64.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.984 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.54 -43.14 70.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.894 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -64.35 -32.06 73.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.163 0.506 . . . . 0.0 110.287 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.558 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -66.78 -53.32 34.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.874 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -47.37 72.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.793 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 25' ' ' VAL . 12.2 pt-20 -64.45 -31.37 72.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.923 0.392 . . . . 0.0 111.027 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ASN . . . . . 0.483 ' O ' HD12 ' A' ' 27' ' ' LEU . 6.4 m-20 -66.75 -53.14 36.33 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.771 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt -50.06 -52.16 36.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 22' ' ' GLU . 29.6 m -55.29 -40.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 27' ' ' LEU . 25.4 m -80.11 -40.66 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.353 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.662 HD11 HG21 ' A' ' 26' ' ' VAL . 11.0 mp -61.89 -27.14 68.59 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.15 -39.09 82.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.375 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.645 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -69.08 -33.82 74.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.247 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.493 ' HB3' HD11 ' A' ' 71' ' ' LEU . . . -69.45 -43.85 72.44 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.2 t -65.28 -36.93 85.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.429 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.645 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.7 OUTLIER -67.87 -43.3 86.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.987 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ALA . . . . . 0.481 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.73 -43.42 97.91 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.915 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.428 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.04 -49.8 71.65 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.447 -0.882 . . . . 0.0 111.206 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . 0.53 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.51 -21.26 66.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.085 -0.557 . . . . 0.0 110.215 178.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.508 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 m-70 -75.73 -32.7 60.14 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.562 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.65 59.84 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.959 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.603 ' O ' HD21 ' A' ' 42' ' ' LEU . 11.6 tt -77.75 -36.86 23.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.52 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LEU . . . . . 0.651 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.68 -37.19 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.651 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -70.32 -38.57 74.96 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 120.865 0.364 . . . . 0.0 111.061 -178.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.49 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 11.7 m-85 -77.42 -33.56 54.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.54 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.603 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -57.17 -47.2 81.79 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.308 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.5 t -70.01 -54.2 20.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.138 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' PHE . . . . . 1.648 ' HD1' ' CD2' ' A' ' 44' ' ' PHE . 22.2 m-85 -76.42 -54.37 6.83 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PHE . . . . . 1.62 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.92 -45.71 48.86 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.484 -175.232 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' CYS . . . . . 0.513 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 31.6 t -59.27 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.463 -178.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.49 -142.39 0.44 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.11 9.08 9.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.948 0.404 . . . . 0.0 110.625 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -90.52 -25.19 20.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' TYR . . . . . 0.468 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.1 p90 -66.08 -26.69 67.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.216 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.43 -28.6 41.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.841 0.353 . . . . 0.0 110.671 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -54.46 -52.34 62.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.143 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.6 42.22 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.31 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.468 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 9.8 ptp180 -147.75 96.28 2.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.635 0.731 . . . . 0.0 111.546 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.424 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -71.41 -18.02 62.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.793 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.532 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.36 -52.41 0.17 Allowed Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . 0.593 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -47.63 -45.18 24.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 121.284 1.323 . . . . 0.0 111.944 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -48.89 44.24 Favored Glycine 0 CA--C 1.505 -0.551 0 CA-C-N 115.941 -0.572 . . . . 0.0 113.523 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.68 88.23 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.938 -0.631 . . . . 0.0 111.373 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ALA . . . . . 0.49 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -64.2 -33.97 77.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.212 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . 1.633 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 3.7 m-85 -74.53 -43.21 56.9 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.812 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.2 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.023 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PHE . . . . . 0.652 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.0 m-85 -71.13 -54.77 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.761 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -77.85 -23.6 48.86 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.58 -29.49 48.33 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 119.888 -1.148 . . . . 0.0 111.617 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.01 -28.5 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.7 -50.44 73.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 114.944 -1.026 . . . . 0.0 111.048 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.6 Cg_endo -65.18 -38.93 25.34 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.082 2.522 . . . . 0.0 112.171 -178.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.467 HD11 HD21 ' A' ' 73' ' ' LEU . 1.7 tm? -57.55 -56.49 21.18 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LEU . . . . . 0.44 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.1 mp -56.64 -50.73 71.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.085 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 30' ' ' ALA . 63.6 mt -49.82 -53.43 25.48 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LEU . . . . . 0.546 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.7 tt -57.21 -42.99 82.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.542 0.21 . . . . 0.0 111.482 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LEU . . . . . 0.467 HD21 HD11 ' A' ' 69' ' ' LEU . 4.6 mm? -72.02 -38.2 69.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.44 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.0 OUTLIER -82.65 -20.74 35.68 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.406 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ALA . . . . . 0.536 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -93.25 -4.74 51.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 109.464 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.546 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.3 tp . . . . . 0 CA--C 1.529 0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.103 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.483 0.891 0 N-CA-C 111.089 -0.389 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 2.0 pt? -71.03 -17.7 62.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.52 -33.87 60.68 Favored Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.352 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.619 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 48.9 m -57.9 -50.91 85.48 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.864 0.332 . . . . 0.0 111.864 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.619 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 34.8 Cg_exo -61.32 -35.5 83.83 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.126 1.884 . . . . 0.0 112.186 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.95 -38.28 90.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.682 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.62 ' HE2' ' CE1' ' A' ' 8' ' ' PHE . 74.7 t80 -70.96 -31.73 68.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.567 179.732 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.24 -40.97 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.217 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.22 83.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.263 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -68.25 -38.66 82.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -60.76 -41.76 96.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.034 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -63.34 -30.54 71.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.802 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -70.24 -47.94 59.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.55 -31.26 72.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -72.09 -32.48 67.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -75.85 -40.93 53.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -68.19 -41.95 80.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.876 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.497 ' HZ3' HD22 ' A' ' 23' ' ' ASN . 6.8 tmtm? -63.51 -37.0 85.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.637 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.547 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.77 -53.0 46.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.155 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.494 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.38 -46.6 73.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.877 -179.084 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.494 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.3 pt-20 -65.68 -32.47 74.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.741 0.305 . . . . 0.0 111.399 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.497 HD22 ' HZ3' ' A' ' 19' ' ' LYS . 0.9 OUTLIER -67.07 -54.49 20.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.746 0.308 . . . . 0.0 111.256 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.7 mt -50.72 -52.02 44.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG21 ' N ' ' A' ' 26' ' ' VAL . 32.7 m -54.84 -42.75 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.435 ' N ' HG21 ' A' ' 25' ' ' VAL . 53.6 t -77.01 -51.64 18.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.61 0.243 . . . . 0.0 111.48 -179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.575 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 11.0 mp -53.51 -35.13 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -62.38 -38.01 87.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.307 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.655 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -67.34 -32.57 73.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.763 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.488 ' HB2' HD11 ' A' ' 71' ' ' LEU . . . -69.68 -41.27 75.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.304 0.573 . . . . 0.0 109.508 177.841 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.1 t -67.39 -36.91 82.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.359 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.655 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -68.25 -43.63 84.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.96 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.433 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.32 -42.87 99.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.91 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.42 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -63.15 -49.67 69.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.117 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.524 ' O ' ' HG ' ' A' ' 39' ' ' LEU . . . -65.53 -20.66 66.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.102 178.16 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.8 m-70 -75.79 -31.9 59.66 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.562 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.58 -33.47 58.24 Favored Glycine 0 N--CA 1.435 -1.393 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.097 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.598 ' O ' HD21 ' A' ' 42' ' ' LEU . 11.9 tt -78.25 -35.99 20.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.45 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.646 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.18 -36.49 58.66 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.646 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -70.97 -38.26 72.76 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 120.798 0.332 . . . . 0.0 111.015 -178.892 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.503 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.48 -33.5 54.51 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.471 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.598 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -57.93 -46.47 84.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.971 0.891 . . . . 0.0 108.698 176.238 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 89.0 t -70.42 -53.26 23.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.093 -179.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.621 ' HD2' ' CD1' ' A' ' 44' ' ' PHE . 7.6 m-85 -76.21 -54.39 6.87 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.619 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.623 ' HD2' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -75.82 -45.7 34.49 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 113.886 -1.507 . . . . 0.0 114.556 -175.266 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.623 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 16.1 t -54.9 -80.85 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.054 0.388 . . . . 0.0 111.356 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 51.16 -147.98 0.38 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.3 7.87 9.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.928 0.394 . . . . 0.0 110.865 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -90.97 -25.39 19.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.191 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.607 ' HE2' ' CE1' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -69.27 -26.29 64.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.563 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.438 HG12 ' O ' ' A' ' 48' ' ' ALA . 38.9 pt -68.9 -29.48 43.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.823 0.344 . . . . 0.0 111.055 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -55.08 -39.16 68.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.839 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 162.33 34.06 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.881 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.523 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.2 ttm180 -129.12 95.98 4.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.876 0.846 . . . . 0.0 110.569 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.461 ' O ' ' N ' ' A' ' 58' ' ' GLY . 44.8 mt -75.64 -20.11 58.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.726 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -26.48 -54.82 0.2 Allowed Pre-proline 0 N--CA 1.47 0.542 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HD3' ' HB2' ' A' ' 56' ' ' ALA . 86.5 Cg_exo -48.74 -42.9 35.95 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.696 1.597 . . . . 0.0 112.056 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.461 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.76 -49.24 41.77 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.42 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.52 -38.91 91.81 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.896 -0.652 . . . . 0.0 111.262 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.503 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.91 -35.56 80.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.343 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.623 ' HH ' ' HB2' ' A' ' 46' ' ' CYS . 3.7 m-85 -73.57 -43.13 60.58 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.826 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.9 -39.31 83.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.013 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.642 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -70.76 -54.85 10.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.605 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 1.4 m-85 -78.12 -23.28 47.9 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.22 -29.87 48.47 Favored Glycine 0 CA--C 1.518 0.263 0 C-N-CA 119.736 -1.221 . . . . 0.0 111.521 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.27 -27.21 4.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.17 -49.95 78.43 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.913 178.534 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.771 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.8 Cg_endo -65.78 -38.05 25.35 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.161 2.574 . . . . 0.0 112.071 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.74 -55.13 39.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.447 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.1 mp -56.24 -51.12 69.28 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.783 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.488 HD11 ' HB2' ' A' ' 30' ' ' ALA . 77.5 mt -51.21 -49.41 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.387 0.429 . . . . 0.0 111.667 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.569 HD13 HD21 ' A' ' 27' ' ' LEU . 31.0 tp -57.12 -45.76 83.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.712 0.291 . . . . 0.0 111.229 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.25 -38.61 71.91 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.447 HD22 ' O ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -81.59 -23.62 36.97 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.733 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.575 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -91.42 -0.38 57.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.41 0.624 . . . . 0.0 109.377 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.5 ' HG ' ' HB1' ' A' ' 80' ' ' ALA . 18.9 tp -109.33 135.61 20.25 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.366 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.472 ' HD2' HD13 ' A' ' 76' ' ' LEU . 75.4 Cg_exo -49.98 158.3 2.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.508 2.138 . . . . 0.0 112.439 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.416 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 31.0 Cg_endo -62.75 -50.79 3.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.351 2.034 . . . . 0.0 113.023 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -64.64 -23.04 67.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.948 0.404 . . . . 0.0 110.978 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.5 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -76.72 -47.14 22.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.361 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.661 ' HE2' ' CE1' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -74.04 -24.54 59.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.882 0.372 . . . . 0.0 110.42 -179.676 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.52 65.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.85 -18.71 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.89 -10.6 56.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -90.74 148.61 22.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.049 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 65.6 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.965 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 111.222 -0.338 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.12 -18.65 63.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.077 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.81 -33.75 59.93 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.254 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.472 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 63.1 m -52.13 -51.3 72.9 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.472 ' HD2' ' N ' ' A' ' 5' ' ' SER . 36.2 Cg_endo -66.22 -28.84 47.62 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 121.939 1.759 . . . . 0.0 112.658 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.43 -49.61 70.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.659 ' HE2' ' CE1' ' A' ' 8' ' ' PHE . 71.6 m-85 -67.23 -42.45 83.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.218 -179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.21 -36.75 80.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.13 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.7 -37.09 67.94 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.3 tpp -65.91 -34.88 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -66.0 -35.79 81.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -64.64 -41.99 95.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.695 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -64.95 -48.73 73.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.108 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -63.49 -33.29 75.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.422 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.07 -33.91 65.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.066 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -73.79 -40.76 63.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.965 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.98 -35.32 76.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.948 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -66.0 -40.71 91.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.76 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.574 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.31 -48.12 74.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.62 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -49.52 69.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.44 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.64 -31.46 71.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.366 . . . . 0.0 110.723 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.504 ' O ' HD12 ' A' ' 27' ' ' LEU . 26.8 t-20 -61.42 -53.86 51.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.968 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.574 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.8 mt -55.55 -39.88 71.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.799 0.333 . . . . 0.0 110.672 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.74 -46.12 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.909 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.4 t -73.6 -41.05 55.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.538 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.562 ' HG ' ' HB1' ' A' ' 75' ' ' ALA . 11.1 mp -58.6 -27.6 64.81 Favored 'General case' 0 CA--C 1.522 -0.102 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.81 -32.57 71.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.218 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.645 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -74.32 -36.05 63.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.884 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.452 ' HB2' HD11 ' A' ' 71' ' ' LEU . . . -69.09 -40.41 78.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.3 t -67.66 -39.42 84.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.276 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.645 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.6 -41.59 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.5 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.8 -41.08 97.3 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.457 179.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.31 -49.97 69.29 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.183 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.565 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.96 -20.18 65.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.32 -0.44 . . . . 0.0 110.262 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.8 m-70 -75.77 -31.68 59.61 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.61 -31.5 56.28 Favored Glycine 0 N--CA 1.433 -1.564 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.511 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.565 HG23 ' O ' ' A' ' 35' ' ' ALA . 13.9 tt -78.43 -35.11 18.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.215 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.67 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.94 -35.79 50.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.896 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.67 ' N ' HD13 ' A' ' 39' ' ' LEU . 36.8 p -71.52 -37.96 71.14 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.072 0.463 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.648 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 15.6 m-85 -75.56 -35.9 60.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.483 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.466 HD12 HG12 ' A' ' 38' ' ' ILE . 2.2 mp -56.89 -43.71 81.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 82.2 t -70.86 -47.79 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.751 -179.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.667 ' HE1' ' CE2' ' A' ' 44' ' ' PHE . 0.2 OUTLIER -75.47 -53.7 8.23 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -178.103 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.643 ' HE1' ' CE2' ' A' ' 45' ' ' PHE . 17.0 m-85 -80.98 -48.15 12.66 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.572 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.0 t -62.19 1.99 0.27 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.703 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.575 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -44.54 153.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.425 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.94 5.69 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.575 ' H ' ' C ' ' A' ' 47' ' ' ALA . 38.8 m95 -90.2 -23.49 21.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.603 0.24 . . . . 0.0 111.076 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.62 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -69.03 -14.09 62.83 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.865 0.364 . . . . 0.0 110.755 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 48' ' ' ALA . 14.6 pt -68.55 -26.9 34.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.511 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -52.35 -39.77 61.12 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.357 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.08 39.14 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.986 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.5 ptt180 -135.11 102.34 5.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.751 0.786 . . . . 0.0 111.619 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.452 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -73.17 -17.5 61.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.522 178.589 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.536 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.05 -51.86 0.15 Allowed Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.728 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.1 Cg_exo -47.82 -48.5 15.85 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.418 1.412 . . . . 0.0 112.019 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.427 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.57 -48.26 28.73 Favored Glycine 0 CA--C 1.508 -0.37 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.066 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.94 93.81 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.357 -0.421 . . . . 0.0 111.969 -178.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.433 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.47 -31.5 72.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.313 0.578 . . . . 0.0 110.175 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.639 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -78.05 -45.13 24.42 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.207 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -35.87 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.239 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.643 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.4 t80 -71.33 -55.29 8.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.328 -179.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.765 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -78.33 -23.19 47.12 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.444 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -79.31 -29.39 49.99 Favored Glycine 0 CA--C 1.517 0.194 0 C-N-CA 119.994 -1.098 . . . . 0.0 111.29 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.82 -28.46 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.649 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.29 -49.91 73.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.669 178.72 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.4 Cg_endo -62.75 -39.51 42.27 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.887 2.391 . . . . 0.0 111.611 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.422 ' O ' HD12 ' A' ' 73' ' ' LEU . 10.1 tt -57.36 -59.41 5.18 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.455 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.0 mp -51.02 -50.82 57.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.729 178.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.452 HD11 ' HB2' ' A' ' 30' ' ' ALA . 98.2 mt -52.62 -45.6 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.275 0.36 . . . . 0.0 111.75 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.19 -44.74 95.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.341 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.422 HD12 ' O ' ' A' ' 69' ' ' LEU . 10.4 mp -71.54 -38.58 71.04 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.455 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -80.57 -28.04 37.31 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.743 -179.706 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.562 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -86.87 -0.04 55.78 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.525 HD13 ' HD2' ' A' ' 77' ' ' PRO . 39.6 tp -116.54 129.49 25.23 Favored Pre-proline 0 C--O 1.231 0.117 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.91 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.525 ' HD2' HD13 ' A' ' 76' ' ' LEU . 88.3 Cg_exo -48.31 132.1 23.5 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.016 1.811 . . . . 0.0 111.493 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.64 -36.43 50.4 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.515 2.143 . . . . 0.0 112.369 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -66.77 -29.44 69.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.28 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.502 ' HB2' ' HG ' ' A' ' 76' ' ' LEU . . . -71.15 -55.31 8.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.078 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.501 ' HB2' HD21 ' A' ' 76' ' ' LEU . 14.2 t80 -68.63 -19.44 64.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.121 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.04 -49.97 45.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.985 0.421 . . . . 0.0 110.575 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.47 -11.32 60.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.113 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -87.18 -13.6 43.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.22 139.36 30.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.207 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.7 p . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.986 179.98 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.484 0.939 0 N-CA-C 111.194 -0.349 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 8.7 mp -71.56 -18.96 62.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.167 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.26 -33.76 58.68 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.2 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.479 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 49.7 m -54.0 -50.67 82.87 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.479 ' HD2' ' N ' ' A' ' 5' ' ' SER . 55.5 Cg_endo -69.45 -38.75 8.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.096 1.864 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.25 -45.28 93.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.497 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.628 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 86.6 t80 -69.3 -37.23 77.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.185 -179.7 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.92 -33.52 73.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.294 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.77 -41.48 62.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.76 -32.0 73.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.796 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.95 -37.27 83.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.745 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.65 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 92.6 t80 -64.22 -45.26 89.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.001 -179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -61.85 -51.09 69.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -60.45 -39.97 89.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.267 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.33 -34.74 78.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.096 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -74.3 -37.27 63.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -70.55 -32.88 70.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.981 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -72.23 -38.33 68.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.826 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.467 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.94 -50.36 56.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.43 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.96 -48.68 72.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.271 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.43 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.8 pt-20 -63.96 -33.98 76.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.622 0.248 . . . . 0.0 110.794 -179.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.547 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 7.7 m120 -58.83 -52.55 65.26 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.467 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 2.4 mt -48.17 -50.4 29.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.524 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.1 t -49.75 -53.92 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.276 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.56 -45.66 77.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.547 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 73.3 mt -61.52 -24.34 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.705 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -67.27 -30.4 70.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.641 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.84 -31.28 66.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.007 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.98 76.71 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.49 ' HB2' HD22 ' A' ' 72' ' ' LEU . 33.7 t -65.32 -43.27 91.54 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.997 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.641 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -62.28 -40.43 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.51 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.519 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.44 -43.18 99.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.608 179.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.425 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.75 -49.54 75.12 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.559 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.81 -19.94 65.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.146 -0.527 . . . . 0.0 110.352 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.507 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.7 m-70 -76.17 -31.57 58.58 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.605 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.26 -32.0 56.37 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.531 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.565 ' O ' HD21 ' A' ' 42' ' ' LEU . 12.9 tt -77.67 -36.2 22.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.285 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.672 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.08 -36.29 55.92 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.672 ' N ' HD13 ' A' ' 39' ' ' LEU . 48.6 p -71.15 -36.37 72.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 110.649 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 17.0 m-85 -78.23 -35.98 47.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.565 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -55.74 -46.11 77.86 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.92 0.867 . . . . 0.0 108.709 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 97.8 t -70.33 -49.36 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.123 -179.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.637 ' HD1' ' CD2' ' A' ' 44' ' ' PHE . 1.4 m-85 -75.98 -54.0 7.53 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.708 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 6.8 m-85 -77.18 -48.68 16.97 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.463 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.4 t -53.1 -81.28 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.568 -175.459 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 41.51 -141.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.451 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 13.11 9.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.885 0.374 . . . . 0.0 110.729 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 20.1 m95 -91.18 -26.27 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.264 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 1.4 p90 -69.02 -31.55 70.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.332 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.451 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.8 pt -61.34 -28.15 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.873 0.368 . . . . 0.0 110.436 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -54.06 -50.89 65.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.077 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.25 40.62 0.04 OUTLIER Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.035 -1.079 . . . . 0.0 113.877 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.549 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 8.0 ptm180 -148.39 105.46 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.741 0.782 . . . . 0.0 111.83 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.432 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.3 pp -74.46 -17.8 60.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.597 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.56 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -24.81 -51.98 0.15 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.708 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 90.7 Cg_exo -47.86 -49.17 14.26 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.331 1.354 . . . . 0.0 111.878 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -49.15 -49.68 29.98 Favored Glycine 0 CA--C 1.505 -0.564 0 CA-C-N 115.995 -0.548 . . . . 0.0 113.616 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.67 -42.42 99.61 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.017 -0.592 . . . . 0.0 111.619 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.43 -36.97 76.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.296 0.57 . . . . 0.0 110.217 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.609 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.2 m-30 -72.07 -46.49 56.67 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.025 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.8 88.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.704 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.611 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.4 m-85 -71.51 -54.18 11.41 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.653 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.4 OUTLIER -77.66 -24.59 49.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.78 -31.54 43.97 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.54 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.26 -25.79 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.621 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.05 -51.69 59.64 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.639 178.331 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.78 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.72 -39.4 26.76 Favored 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 122.95 2.434 . . . . 0.0 112.257 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tt -58.26 -54.42 47.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.844 0.354 . . . . 0.0 110.415 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.49 ' HG ' HD22 ' A' ' 74' ' ' LEU . 6.4 tp -58.01 -53.8 54.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.37 -52.57 27.46 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.49 HD22 ' HB2' ' A' ' 31' ' ' SER . 2.7 mm? -57.55 -45.08 85.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 85.5 mt -69.62 -38.45 77.23 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.49 HD22 ' HG ' ' A' ' 70' ' ' LEU . 1.7 pp -82.27 -19.97 38.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.028 0.442 . . . . 0.0 110.201 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.419 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -93.95 -7.17 43.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.761 178.57 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.528 HD13 ' HD2' ' A' ' 77' ' ' PRO . 17.2 tp -99.93 134.97 20.58 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.129 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.528 ' HD2' HD13 ' A' ' 76' ' ' LEU . 88.3 Cg_exo -45.22 152.85 0.61 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.585 2.19 . . . . 0.0 112.873 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.401 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 31.4 Cg_exo -58.97 -50.78 8.13 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.525 2.15 . . . . 0.0 113.044 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -63.6 -25.93 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.407 . . . . 0.0 110.976 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.499 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.32 -47.63 26.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.63 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.609 ' HD1' ' CD2' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -76.17 -28.11 57.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.757 0.313 . . . . 0.0 110.992 -179.299 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.79 -45.68 70.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.632 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.9 -18.41 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.767 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.09 -14.69 59.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.049 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.79 143.06 27.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.136 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.818 -179.886 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.484 0.923 0 N-CA-C 111.283 -0.314 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.424 ' H ' HD21 ' A' ' 3' ' ' LEU . 2.6 pt? -68.43 -18.57 64.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.198 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.52 -36.12 59.1 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.312 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.454 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 65.7 m -54.31 -51.11 80.77 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.454 ' HD2' ' N ' ' A' ' 5' ' ' SER . 59.3 Cg_endo -71.9 -28.48 16.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.302 2.002 . . . . 0.0 112.682 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.59 -56.12 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.468 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.622 ' HD2' ' CD1' ' A' ' 8' ' ' PHE . 65.4 m-85 -68.18 -31.38 70.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.525 -179.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -44.27 83.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.52 -27.6 63.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.055 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.9 ttt -73.7 -38.19 64.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.12 -33.32 75.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.836 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -69.17 -37.62 78.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -69.35 -42.07 75.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.795 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -66.26 -43.86 85.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.947 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.68 -38.37 90.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.945 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -70.73 -36.65 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.828 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -70.72 -34.22 71.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.056 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -71.1 -39.44 72.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.463 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.25 -47.8 75.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.14 -49.64 73.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.634 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.47 -33.25 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.76 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.457 ' O ' HD11 ' A' ' 27' ' ' LEU . 9.7 m120 -60.7 -41.09 94.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.434 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.6 mt -59.51 -48.34 82.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 110.786 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 3.4 t -49.87 -53.58 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.371 -178.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.619 HG21 HD11 ' A' ' 27' ' ' LEU . 4.8 m -71.49 -39.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.424 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.619 HD11 HG21 ' A' ' 26' ' ' VAL . 1.5 mp -63.66 -24.24 67.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.285 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -69.53 -32.11 70.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.627 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.53 -33.9 67.19 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.725 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.47 -43.79 72.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.281 0.562 . . . . 0.0 109.623 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.408 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -64.18 -38.67 91.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.203 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.627 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.6 OUTLIER -66.26 -40.56 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.448 179.023 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.519 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.64 -43.28 93.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.514 178.856 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.14 77.18 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 178.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.535 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.08 -20.47 66.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.085 -0.558 . . . . 0.0 110.109 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.3 m-70 -75.99 -32.32 59.4 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.575 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.07 -34.08 58.85 Favored Glycine 0 N--CA 1.433 -1.542 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.888 178.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.59 ' O ' HD11 ' A' ' 42' ' ' LEU . 17.5 tt -77.27 -37.22 25.28 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.359 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.664 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.25 -38.23 60.62 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.664 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.54 -38.57 77.53 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.252 -178.69 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.671 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 12.0 m-85 -77.68 -33.49 53.25 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.577 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.59 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.28 -47.07 82.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.919 0.866 . . . . 0.0 108.838 176.468 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.83 -54.41 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.169 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.653 ' HD1' ' CD2' ' A' ' 44' ' ' PHE . 27.4 m-85 -76.36 -54.42 6.78 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -177.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.612 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.32 -46.0 52.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 113.877 -1.51 . . . . 0.0 114.395 -175.347 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.522 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -60.02 -81.42 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.445 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.76 -141.08 0.36 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -119.08 9.97 11.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 -90.26 -27.94 19.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.626 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 1.2 p90 -66.85 -40.21 87.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.824 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -28.73 45.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -54.82 -52.05 63.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.825 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.02 44.77 0.06 OUTLIER Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.375 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.482 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 17.2 ptp180 -157.68 102.44 1.87 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.696 0.76 . . . . 0.0 111.653 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 pp -73.9 -18.38 60.91 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.167 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.567 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.17 -52.99 0.17 Allowed Pre-proline 0 N--CA 1.47 0.534 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.61 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -48.37 -42.9 33.68 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 121.486 1.457 . . . . 0.0 112.16 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -46.91 48.77 Favored Glycine 0 CA--C 1.505 -0.535 0 CA-C-N 115.905 -0.588 . . . . 0.0 113.105 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.06 89.7 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.804 -0.698 . . . . 0.0 111.447 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.46 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -64.62 -32.06 73.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.02 0.438 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.61 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -76.37 -49.35 17.05 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.333 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.25 93.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.836 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 1.66 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 24.5 t80 -71.15 -54.71 10.1 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.773 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.57 -23.94 49.89 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.789 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.52 -29.47 48.71 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.672 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 p -91.28 -29.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.663 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.76 -50.43 73.58 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.187 179.123 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.773 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.37 -40.46 24.75 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 C-N-CA 122.962 2.442 . . . . 0.0 112.075 -178.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.93 -54.75 43.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.382 . . . . 0.0 110.01 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.404 ' O ' HD22 ' A' ' 74' ' ' LEU . 71.7 mt -57.97 -53.34 59.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.411 179.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 86.7 mt -49.58 -52.87 27.16 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.433 0.458 . . . . 0.0 112.11 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 58.8 tp -56.81 -46.21 81.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.634 0.254 . . . . 0.0 111.614 -179.669 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.6 -37.96 77.11 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.404 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.62 -21.72 35.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.002 0.429 . . . . 0.0 110.243 179.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.513 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -91.25 -10.41 41.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.581 178.394 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.576 HD13 ' HD2' ' A' ' 77' ' ' PRO . 24.8 tp -94.2 133.47 27.3 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.576 ' HD2' HD13 ' A' ' 76' ' ' LEU . 96.0 Cg_exo -43.51 152.3 0.3 Allowed 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.709 2.273 . . . . 0.0 112.905 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.86 -53.33 4.55 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.448 2.099 . . . . 0.0 113.07 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -63.26 -25.45 68.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.999 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.471 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.49 -46.88 29.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.577 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.667 ' HD2' ' CD1' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -75.72 -21.52 57.44 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.459 -179.511 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.53 -45.22 62.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.595 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.14 -16.26 63.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.742 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.79 -12.3 53.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.888 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.22 -176.84 4.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.161 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.81 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.481 0.793 0 N-CA-C 111.053 -0.403 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.405 ' C ' ' HD2' ' A' ' 6' ' ' PRO . 39.8 tp -66.4 -18.57 65.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.897 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.42 -33.66 61.14 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.198 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.451 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 59.9 m -54.26 -51.26 79.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.249 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 5' ' ' SER . 60.0 Cg_endo -72.38 -28.26 15.16 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.044 1.829 . . . . 0.0 112.008 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.06 -43.45 98.87 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.047 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -69.22 -47.75 63.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.78 -37.07 78.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.277 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.44 -32.55 64.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.453 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 44.2 ttp -69.54 -45.48 68.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.016 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.12 -31.44 71.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.755 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.635 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 73.9 t80 -66.61 -40.71 88.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.737 179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . 0.4 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 24.6 ttmm -64.26 -48.0 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.706 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.35 -24.26 66.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.17 -53.18 13.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.093 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.4 ' OD2' ' HA ' ' A' ' 14' ' ' LYS . 3.0 p30 -67.63 -30.81 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.978 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -68.83 -45.64 70.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.014 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -64.9 -36.56 84.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.488 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -63.72 -51.3 65.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.402 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.9 -49.51 71.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.638 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.402 ' N ' HD21 ' A' ' 21' ' ' LEU . 11.4 pt-20 -63.68 -35.07 79.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.724 0.297 . . . . 0.0 111.141 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.469 ' O ' HD11 ' A' ' 27' ' ' LEU . 9.9 m120 -59.82 -43.76 94.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.687 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.488 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.9 mt -58.08 -48.58 79.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.03 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 1.4 t -49.68 -53.69 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.193 -178.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.565 HG21 HD11 ' A' ' 27' ' ' LEU . 4.3 m -72.07 -38.64 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.59 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.565 HD11 HG21 ' A' ' 26' ' ' VAL . 1.9 mp -63.96 -24.85 67.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.272 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -70.01 -30.0 67.2 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.642 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.96 -34.77 66.71 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.419 178.464 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.12 78.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.448 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.1 t -66.71 -38.63 87.13 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.642 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -66.52 -41.66 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.508 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.94 -43.86 94.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.487 179.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.6 -49.54 75.66 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.583 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.36 -22.16 66.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.067 -0.567 . . . . 0.0 110.238 178.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.525 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.2 m-70 -75.6 -31.76 60.05 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.555 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.25 -33.9 58.56 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.946 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.616 ' O ' HD11 ' A' ' 42' ' ' LEU . 20.0 tt -77.89 -36.57 22.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.512 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.666 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.7 -37.06 59.79 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.666 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.71 -38.82 77.09 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.489 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 12.5 m-85 -77.6 -32.5 53.64 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.619 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.616 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.76 -46.75 84.1 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.12 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 91.9 t -69.9 -54.16 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 114.949 -1.023 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -76.23 -54.93 6.08 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.608 ' HD2' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.98 -38.15 64.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 113.679 -1.601 . . . . 0.0 114.447 -175.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.666 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 7.4 t -70.57 16.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.849 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.537 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -50.18 156.59 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.466 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.85 8.79 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.537 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.83 -25.84 19.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.659 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.22 63.53 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.616 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.466 HG12 ' O ' ' A' ' 48' ' ' ALA . 30.7 pt -70.03 -29.26 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.287 . . . . 0.0 111.022 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -54.71 -29.91 54.57 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 149.52 30.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 113.138 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.433 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.0 ttm180 -122.52 98.77 6.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.825 0.821 . . . . 0.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.467 HD11 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -75.13 -18.87 60.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.404 179.219 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.575 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.9 -54.49 0.19 Allowed Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.575 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 79.8 Cg_exo -49.09 -45.09 30.74 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.492 1.462 . . . . 0.0 112.027 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.53 -47.26 45.17 Favored Glycine 0 CA--C 1.506 -0.524 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.345 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.57 94.87 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.945 -0.627 . . . . 0.0 111.496 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.489 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.96 -35.13 79.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 0.0 110.238 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.612 ' HD2' ' CD1' ' A' ' 61' ' ' TYR . 3.1 m-30 -73.15 -43.81 60.99 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.863 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.7 -39.44 84.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.007 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 1.644 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 8.3 m-85 -71.01 -54.64 10.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.586 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 1.1 m-85 -77.76 -24.06 49.1 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.36 45.7 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.056 -1.069 . . . . 0.0 111.721 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -91.13 -27.51 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.109 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.43 -50.57 75.76 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.114 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.792 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.6 Cg_endo -64.96 -40.51 20.49 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.112 2.541 . . . . 0.0 112.155 -178.096 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -55.79 30.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.107 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.425 ' O ' HD22 ' A' ' 74' ' ' LEU . 96.5 mt -57.03 -52.61 64.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.223 179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 71.7 mt -49.63 -53.64 22.98 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.362 0.414 . . . . 0.0 112.073 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.424 HD13 HD21 ' A' ' 27' ' ' LEU . 40.2 tp -57.59 -44.7 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.45 -39.67 81.38 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.425 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.3 pp -82.65 -20.15 36.86 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.214 179.806 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.489 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -92.15 -9.51 42.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.523 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.547 HD13 ' HD2' ' A' ' 77' ' ' PRO . 17.5 tp -97.75 133.46 23.42 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.114 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.547 ' HD2' HD13 ' A' ' 76' ' ' LEU . 91.4 Cg_exo -44.79 148.02 1.63 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.577 2.185 . . . . 0.0 112.517 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.441 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 14.6 Cg_endo -56.6 -48.31 19.51 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.559 2.173 . . . . 0.0 112.859 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -61.21 -29.27 69.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.863 0.363 . . . . 0.0 110.885 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.513 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.0 -50.44 16.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.068 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.441 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -72.93 -23.27 60.67 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.979 -179.163 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.28 -43.4 64.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.825 0.345 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.95 -16.35 63.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.002 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -89.12 -13.03 39.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.919 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.48 140.44 33.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.8 m . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.886 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 111.017 -0.416 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 66.4 tp -71.83 -24.37 61.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.162 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.69 -33.49 60.49 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.012 -0.613 . . . . 0.0 113.432 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.445 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 48.1 t -56.15 -51.16 82.92 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -178.911 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 5' ' ' SER . 57.0 Cg_endo -71.26 -34.64 9.65 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.031 1.821 . . . . 0.0 112.568 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.31 -38.82 84.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.81 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -71.54 -35.47 70.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.85 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.91 -34.91 74.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.089 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.55 -48.85 45.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.427 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 91.6 mtp -59.89 -43.62 94.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.99 -37.22 76.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.639 ' HD1' ' CD2' ' A' ' 13' ' ' TYR . 87.0 t80 -60.02 -51.2 70.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.954 179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -60.2 -36.71 78.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -66.34 -37.73 86.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.688 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.55 -45.13 76.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.9 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -67.93 -31.95 72.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.539 ' HA ' HD21 ' A' ' 21' ' ' LEU . 15.6 t70 -67.96 -49.54 61.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.815 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -62.57 -28.59 69.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.719 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.16 66.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.472 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.674 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.1 pp -62.4 -44.13 97.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.674 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 11.9 pt-20 -68.44 -37.58 80.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.795 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.594 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.9 OUTLIER -66.15 -55.02 18.42 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.973 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.7 tp -52.23 -52.0 55.0 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.47 HG23 ' O ' ' A' ' 22' ' ' GLU . 18.8 m -52.34 -44.49 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.442 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.443 ' N ' HG21 ' A' ' 25' ' ' VAL . 53.0 t -75.46 -41.18 42.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.796 0.332 . . . . 0.0 110.993 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.594 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 87.2 mt -63.7 -22.43 66.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.412 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -69.65 -30.39 68.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.633 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.44 -33.63 65.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.442 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.03 76.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.6 t -65.53 -41.08 93.47 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.06 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.633 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.65 -38.89 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.516 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.61 -41.75 97.9 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.277 178.731 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.463 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.11 -49.65 72.93 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.574 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.47 -21.21 66.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.926 -0.637 . . . . 0.0 110.254 178.359 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.504 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.4 m-70 -75.59 -31.75 60.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.603 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.28 -32.95 57.51 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.861 178.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.584 ' O ' HD11 ' A' ' 42' ' ' LEU . 14.0 tt -77.92 -36.08 21.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.335 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.677 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.85 -35.97 57.12 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.989 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.677 ' N ' HD13 ' A' ' 39' ' ' LEU . 32.8 p -70.83 -38.14 73.23 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.071 0.462 . . . . 0.0 110.537 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.449 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 16.4 m-85 -76.01 -35.24 59.62 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.389 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.584 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.5 mp -56.21 -45.49 79.84 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.941 0.877 . . . . 0.0 108.763 176.603 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.98 -48.22 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.097 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.656 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 0.8 OUTLIER -75.77 -53.84 7.87 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -177.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.694 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.4 m-85 -78.82 -48.71 14.24 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.469 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 29.4 t -52.5 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.029 -0.669 . . . . 0.0 111.913 -175.384 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 44.73 -143.16 0.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.74 12.18 9.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.976 0.417 . . . . 0.0 110.846 178.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.9 m95 -91.13 -28.64 17.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.208 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.491 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.26 -28.22 66.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.527 -179.18 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 36.9 pt -65.06 -28.9 45.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.329 . . . . 0.0 111.067 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -54.56 -32.01 57.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.034 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 150.57 44.88 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.608 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -141.78 100.96 3.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.644 0.735 . . . . 0.0 110.664 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.85 -20.03 58.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.249 178.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.96 -54.03 0.19 Allowed Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.694 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.6 Cg_exo -50.14 -47.89 22.08 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.694 1.596 . . . . 0.0 111.94 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.58 -48.03 29.02 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.747 -0.661 . . . . 0.0 113.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.91 -42.86 97.31 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.134 -0.533 . . . . 0.0 111.794 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.449 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.72 -34.7 73.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.304 0.573 . . . . 0.0 110.153 179.146 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.606 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -74.1 -46.24 44.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.969 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.98 92.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.632 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 1.664 ' HD2' ' CD1' ' A' ' 63' ' ' PHE . 8.9 m-85 -71.34 -54.77 9.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.653 ' HD2' ' CD1' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -77.67 -24.31 49.39 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.7 -32.15 42.28 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.493 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.21 -26.11 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.662 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.12 -51.0 72.15 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.942 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.0 Cg_endo -64.44 -40.14 25.67 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 122.841 2.36 . . . . 0.0 112.132 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -57.92 -56.22 24.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.955 0.407 . . . . 0.0 110.342 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.43 ' O ' HD22 ' A' ' 74' ' ' LEU . 63.0 mt -57.44 -54.15 50.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.426 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.4 mt -48.88 -50.95 32.46 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.395 0.434 . . . . 0.0 112.011 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 2.4 tt -59.21 -50.57 73.51 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.655 -179.307 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.57 -37.71 88.51 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.43 HD22 ' O ' ' A' ' 70' ' ' LEU . 2.0 pp -81.6 -24.34 36.5 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.377 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.428 ' O ' HD12 ' A' ' 27' ' ' LEU . . . -90.51 -7.63 52.46 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.369 0.604 . . . . 0.0 109.525 178.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.653 HD23 ' HD2' ' A' ' 77' ' ' PRO . 2.4 tm? -114.46 127.02 27.24 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.496 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.653 ' HD2' HD23 ' A' ' 76' ' ' LEU . 60.4 Cg_exo -38.43 118.57 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.59 2.193 . . . . 0.0 112.432 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.05 -37.69 30.6 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.988 2.459 . . . . 0.0 113.223 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -68.35 -32.27 72.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.756 0.312 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.01 -45.39 34.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.47 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.635 ' HE1' ' CE2' ' A' ' 81' ' ' TYR . 3.9 t80 -70.41 -33.05 70.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.66 0.267 . . . . 0.0 111.088 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.54 -36.79 71.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.879 0.371 . . . . 0.0 110.723 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.72 -22.92 64.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.95 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -82.73 -3.42 56.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.052 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -88.5 145.15 25.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.132 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.904 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 111.115 -0.379 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.449 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 90.2 mt -71.26 -18.81 62.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.65 57.09 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.016 -0.612 . . . . 0.0 113.466 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.594 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 53.0 m -55.57 -50.73 85.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.594 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 51.5 Cg_exo -55.72 -28.74 68.0 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.122 1.881 . . . . 0.0 112.751 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.29 -46.6 82.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.706 0.288 . . . . 0.0 111.155 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -67.34 -36.99 82.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.08 -42.58 84.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.61 -43.41 98.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.989 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.0 ttt -62.87 -34.28 77.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.636 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.06 -42.56 99.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.984 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -63.63 -33.76 76.33 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -69.8 -52.64 23.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -61.09 -32.26 71.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.151 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.93 -31.53 68.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.857 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -77.41 -43.66 31.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.061 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.98 -34.43 78.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.283 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -68.23 -48.91 63.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.226 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.18 78.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.338 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.484 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.01 -46.46 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.546 -179.74 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.484 ' N ' HD21 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -66.75 -37.11 83.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.677 0.275 . . . . 0.0 111.099 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.445 ' O ' HD11 ' A' ' 27' ' ' LEU . 95.2 m-20 -63.13 -38.76 92.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.0 110.613 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.51 -53.65 55.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.454 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.448 HG21 ' O ' ' A' ' 21' ' ' LEU . 23.1 t -51.44 -48.22 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.494 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.563 HG11 HD11 ' A' ' 27' ' ' LEU . 7.4 p -73.32 -36.2 48.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.656 0.265 . . . . 0.0 111.074 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.563 HD11 HG11 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -65.92 -24.01 66.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.034 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.38 -30.6 68.63 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.636 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.32 -33.69 65.28 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.463 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.47 74.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.452 0.644 . . . . 0.0 109.346 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.1 m -65.23 -40.61 94.3 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.318 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.636 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -63.08 -39.62 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.5 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.5 -41.45 97.3 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.381 178.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.17 -49.74 71.9 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.564 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.75 -20.18 65.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.157 -0.522 . . . . 0.0 110.176 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.5 m-70 -75.72 -33.21 60.29 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.607 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.33 -32.91 59.48 Favored Glycine 0 N--CA 1.43 -1.748 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.43 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.564 HG23 ' O ' ' A' ' 35' ' ' ALA . 12.4 tt -77.46 -36.63 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.527 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.634 HD13 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.93 -38.85 57.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.26 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.634 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -71.19 -36.17 71.83 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.981 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.417 ' O ' ' HB2' ' A' ' 45' ' ' PHE . 13.1 m-85 -76.1 -35.93 59.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.121 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.488 HD11 ' CE1' ' A' ' 61' ' ' TYR . 1.8 mp -56.05 -44.83 79.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 92.1 t -70.91 -48.28 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.941 -1.027 . . . . 0.0 112.048 -179.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -53.77 8.12 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.87 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.75 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.8 m-85 -79.23 -47.72 15.46 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -176.543 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.529 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.2 t -60.78 -0.53 0.29 Allowed 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.549 -175.509 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.561 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -46.9 161.18 0.07 Allowed 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.482 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -62.77 10.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.561 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.29 -26.3 20.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.778 0.323 . . . . 0.0 110.532 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -69.48 -33.1 72.38 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.219 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.6 pt -59.56 -27.7 38.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.899 0.38 . . . . 0.0 110.687 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -53.27 -42.39 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.087 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.89 48.62 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.053 -1.07 . . . . 0.0 113.52 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.54 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 13.4 ptp180 -154.88 107.13 2.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.741 0.782 . . . . 0.0 111.708 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.447 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 4.4 pp -74.12 -16.84 61.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.618 178.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.524 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -23.99 -51.52 0.12 Allowed Pre-proline 0 N--CA 1.467 0.384 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.75 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 82.3 Cg_exo -47.39 -49.96 12.14 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 121.379 1.386 . . . . 0.0 111.823 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.415 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.39 -48.07 27.84 Favored Glycine 0 CA--C 1.509 -0.307 0 CA-C-N 115.879 -0.6 . . . . 0.0 113.905 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.27 97.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.141 -0.529 . . . . 0.0 112.049 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.4 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.189 0.519 . . . . 0.0 110.126 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.633 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -75.45 -45.03 41.13 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.179 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.05 83.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.683 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 23.5 t80 -71.19 -54.54 10.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.29 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.652 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.3 OUTLIER -77.62 -23.77 49.73 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.466 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -80.02 -29.19 47.39 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.614 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -90.94 -29.08 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.683 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.81 -50.44 73.83 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.978 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.783 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.6 Cg_endo -63.84 -39.57 32.89 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.933 2.422 . . . . 0.0 111.902 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.1 -58.24 9.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.918 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.3 mp -56.62 -51.51 68.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.32 179.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.2 mt -49.33 -52.64 26.64 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 47.6 tp -59.31 -44.25 92.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.4 tp -70.34 -39.08 74.9 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.91 -25.79 34.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.005 0.431 . . . . 0.0 110.411 179.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.52 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -85.79 -8.55 58.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.621 HD11 ' HD2' ' A' ' 77' ' ' PRO . 33.8 tp -94.89 127.91 41.34 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.777 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.621 ' HD2' HD11 ' A' ' 76' ' ' LEU . 79.0 Cg_exo -41.44 151.63 0.14 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.931 2.421 . . . . 0.0 113.272 -179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.432 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 53.2 Cg_exo -54.77 -55.49 3.22 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.55 2.167 . . . . 0.0 113.222 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -61.73 -27.57 68.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.828 0.346 . . . . 0.0 111.111 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.417 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.04 -46.27 36.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.929 -179.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.432 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -76.89 -27.17 54.88 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.063 -178.936 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.27 -44.01 66.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.89 0.376 . . . . 0.0 110.661 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.68 -17.02 63.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -85.28 -12.93 51.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.101 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.12 163.24 18.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.192 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.111 179.892 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo . . . . . 0 N--CA 1.485 0.987 0 N-CA-C 111.166 -0.359 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.469 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 3.8 mm? -69.11 -18.0 63.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.159 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.81 -33.73 59.92 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.439 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.596 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 42.4 t -56.96 -50.86 85.76 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.596 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 45.3 Cg_exo -56.41 -28.62 73.84 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.069 1.846 . . . . 0.0 112.466 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -58.1 -50.35 73.78 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.665 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 88.9 m-85 -64.19 -36.47 84.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -32.7 73.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.57 -36.79 60.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.082 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 85.9 mtp -70.54 -35.66 73.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.23 -35.71 81.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.789 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -67.03 -36.34 81.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.387 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -66.46 -50.23 64.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.607 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.96 -41.33 91.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.865 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -62.53 -32.62 73.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.588 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.26 -41.71 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.675 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -66.43 -31.39 72.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -72.53 -35.68 68.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.724 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.19 -48.22 68.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.432 ' O ' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -57.68 -49.5 76.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.5 -35.7 81.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.666 0.269 . . . . 0.0 111.567 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.45 ' O ' HD11 ' A' ' 27' ' ' LEU . 11.0 m120 -65.87 -42.51 90.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.787 0.327 . . . . 0.0 111.012 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.08 -55.74 30.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' O ' ' A' ' 21' ' ' LEU . 2.3 m -52.81 -43.91 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.295 -178.123 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -72.1 -41.59 67.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.807 0.337 . . . . 0.0 110.946 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HB3' HD21 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -64.67 -22.93 67.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.508 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -69.31 -34.25 74.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.633 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.95 -33.16 65.71 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.723 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -44.69 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.286 0.565 . . . . 0.0 109.601 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.406 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 43.2 t -64.37 -39.6 94.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.212 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.633 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -64.5 -40.76 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.246 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.484 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.39 -42.31 95.64 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.338 178.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.93 -49.36 76.39 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.564 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.01 -21.35 66.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.254 178.441 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.507 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 10.1 m-70 -75.96 -33.28 59.79 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.573 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.82 -33.42 60.17 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.924 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.598 ' O ' HD11 ' A' ' 42' ' ' LEU . 18.9 tt -77.78 -36.77 22.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.479 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.648 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.49 -37.95 59.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.648 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.19 -38.47 78.65 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 120.75 0.309 . . . . 0.0 111.016 -178.778 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.484 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 9.0 m-85 -77.9 -32.78 51.94 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.459 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 38' ' ' ILE . 0.9 OUTLIER -57.68 -46.99 83.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 122.024 0.916 . . . . 0.0 108.674 176.399 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 90.6 t -70.15 -53.92 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.007 -179.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.63 ' HE1' ' CE2' ' A' ' 44' ' ' PHE . 12.3 m-85 -76.07 -54.28 7.08 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 -177.611 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.521 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.31 -45.82 45.0 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.039 -1.437 . . . . 0.0 114.387 -175.331 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.531 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -61.09 -81.15 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.317 -179.008 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.97 -144.83 0.35 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.453 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.11 13.49 10.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.12 -35.3 14.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.011 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -63.2 -13.69 40.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.344 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.453 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.9 pt -67.05 -28.55 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.055 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -53.82 -29.6 41.46 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.684 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.11 30.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.749 . . . . 0.0 113.069 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.462 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.7 ttm180 -117.83 99.17 6.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.674 0.75 . . . . 0.0 110.253 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.453 ' O ' ' N ' ' A' ' 58' ' ' GLY . 0.0 OUTLIER -74.71 -19.89 60.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.59 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -26.22 -54.21 0.19 Allowed Pre-proline 0 N--CA 1.467 0.418 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 88.0 Cg_exo -48.4 -45.83 25.33 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.589 1.526 . . . . 0.0 112.032 178.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.26 -47.03 43.48 Favored Glycine 0 CA--C 1.506 -0.496 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.411 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.29 95.93 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.9 -0.65 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.484 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.14 -33.38 74.37 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.108 0.48 . . . . 0.0 110.228 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.618 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 3.1 m-85 -75.26 -44.2 47.18 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.833 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.2 87.58 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.779 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.645 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.53 -54.65 9.85 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -77.68 -24.13 49.38 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.47 45.25 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.045 -1.074 . . . . 0.0 111.574 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.25 -26.74 5.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.647 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.35 -50.49 75.88 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.829 178.657 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.7 Cg_endo -64.06 -39.64 30.82 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 122.974 2.449 . . . . 0.0 111.973 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.29 -56.27 23.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.048 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -57.32 -52.81 63.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.418 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.2 mt -49.28 -52.9 24.62 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.51 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 3.2 tm? -56.59 -45.17 81.55 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.6 mt -71.14 -39.09 72.19 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.69 -21.02 38.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.969 0.414 . . . . 0.0 110.5 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.493 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -93.65 -8.99 39.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.88 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.548 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 5.1 tp -73.95 145.66 84.07 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.404 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.548 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 53.6 Cg_exo -52.65 161.76 2.81 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.886 1.724 . . . . 0.0 111.086 178.737 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.24 -62.18 0.24 Allowed 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 121.866 1.71 . . . . 0.0 113.347 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.3 mmt180 -63.03 -24.71 68.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.72 0.295 . . . . 0.0 111.298 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.98 -45.05 36.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.546 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.648 ' HD1' ' CD2' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -78.91 -24.43 44.1 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.583 -178.943 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.5 -43.92 65.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.419 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.44 -16.86 63.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.45 -16.25 56.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.798 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.06 171.82 11.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.14 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.965 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.484 0.95 0 N-CA-C 111.224 -0.337 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -71.49 -20.58 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.809 179.822 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.07 -33.74 59.17 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.939 -0.648 . . . . 0.0 113.26 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.486 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 63.5 m -54.95 -51.04 82.72 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.486 ' HD2' ' N ' ' A' ' 5' ' ' SER . 47.5 Cg_endo -68.98 -28.03 29.52 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.068 1.846 . . . . 0.0 112.492 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.34 -53.17 61.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -66.31 -38.79 88.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.354 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.69 84.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.56 -36.93 68.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.979 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 tpp -65.81 -41.61 91.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.43 -37.73 81.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.728 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -62.31 -43.45 98.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.673 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -62.9 -55.33 26.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.015 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -57.45 -32.51 67.0 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.377 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.06 -44.07 77.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -69.45 -33.1 72.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.75 -37.27 73.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.165 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -70.95 -34.79 71.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -68.72 -52.83 26.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.439 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.23 -45.19 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.496 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.439 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.7 pt-20 -66.95 -30.98 71.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.864 0.364 . . . . 0.0 110.736 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.472 ' O ' HD11 ' A' ' 27' ' ' LEU . 7.3 m-20 -68.0 -42.33 80.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.232 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.9 mt -62.78 -51.51 66.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.737 0.303 . . . . 0.0 111.715 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.434 HG21 ' N ' ' A' ' 26' ' ' VAL . 34.6 m -53.2 -45.43 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.558 HG11 HD11 ' A' ' 27' ' ' LEU . 8.3 p -74.91 -37.51 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.778 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.558 HD11 HG11 ' A' ' 26' ' ' VAL . 1.2 mp -64.32 -22.92 67.12 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.857 -0.424 . . . . 0.0 109.857 179.163 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -70.39 -31.2 68.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.294 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.624 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.14 -35.31 66.47 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.46 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.83 -38.89 80.16 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.418 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 32.9 t -66.81 -40.47 88.07 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.075 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.624 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.49 -39.24 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.021 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.517 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.09 -43.4 98.94 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.387 179.009 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.84 -49.3 77.25 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.561 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -65.91 -21.59 66.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.071 -0.565 . . . . 0.0 110.284 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.493 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 8.1 m-70 -73.89 -31.9 63.33 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.582 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.54 -32.5 57.53 Favored Glycine 0 N--CA 1.434 -1.437 0 CA-C-N 114.086 -1.415 . . . . 0.0 111.006 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.58 ' O ' HD11 ' A' ' 42' ' ' LEU . 14.6 tt -78.13 -35.97 20.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.279 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.672 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.11 -35.43 56.38 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.672 ' N ' HD13 ' A' ' 39' ' ' LEU . 34.0 p -70.22 -38.59 75.28 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.023 0.44 . . . . 0.0 110.969 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.667 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 11.9 m-85 -78.45 -34.0 48.05 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.849 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.58 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -57.04 -47.14 81.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.009 0.909 . . . . 0.0 108.711 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.8 t -70.26 -54.39 18.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.291 -179.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.64 ' HD2' ' CD1' ' A' ' 44' ' ' PHE . 27.3 t80 -76.4 -54.56 6.56 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -177.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.5 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.44 -37.49 65.83 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 113.956 -1.474 . . . . 0.0 114.422 -175.303 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.63 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 8.0 t -70.56 16.18 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.089 0.404 . . . . 0.0 111.79 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.527 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -48.69 153.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.483 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -60.17 5.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.527 ' H ' ' C ' ' A' ' 47' ' ' ALA . 55.3 m95 -90.06 -24.83 21.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.64 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 0.6 OUTLIER -69.23 -22.05 63.89 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.161 -179.637 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.483 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -69.09 -29.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.217 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -54.86 -42.88 72.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.628 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 164.76 30.65 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.066 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.443 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -120.98 97.01 5.33 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.855 0.836 . . . . 0.0 110.449 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 39.4 mt -75.14 -18.91 60.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.182 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.89 -53.72 0.19 Allowed Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.593 ' HD3' ' HB2' ' A' ' 56' ' ' ALA . 81.0 Cg_exo -49.52 -45.18 32.09 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.537 1.492 . . . . 0.0 112.056 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.38 -49.78 37.42 Favored Glycine 0 CA--C 1.505 -0.59 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.474 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.12 88.81 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.871 -0.665 . . . . 0.0 111.219 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.476 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.78 -36.84 84.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.241 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.61 ' HD2' ' CD1' ' A' ' 61' ' ' TYR . 2.5 m-85 -72.14 -43.87 63.99 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.765 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.3 87.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.893 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.637 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -71.46 -55.01 8.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.61 ' HD2' ' CD1' ' A' ' 64' ' ' TYR . 0.8 OUTLIER -77.81 -24.16 48.85 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.44 -31.25 46.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 119.984 -1.103 . . . . 0.0 111.68 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -91.67 -26.47 5.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.639 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.64 -50.57 71.99 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.862 178.588 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.776 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 41.6 Cg_endo -64.79 -39.83 24.43 Favored 'Trans proline' 0 N--CA 1.448 -1.167 0 C-N-CA 122.978 2.452 . . . . 0.0 112.262 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.55 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.983 0.42 . . . . 0.0 110.339 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' HD22 ' A' ' 74' ' ' LEU . 63.2 mt -58.53 -53.83 53.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.096 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.9 mt -49.58 -51.67 35.52 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.347 0.404 . . . . 0.0 112.089 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.1 tt -58.2 -43.9 87.82 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 78.5 mt -70.99 -39.12 72.64 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -81.74 -23.2 36.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 110.353 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.524 ' HB2' HD12 ' A' ' 27' ' ' LEU . . . -89.83 -7.14 55.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.474 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tp -82.11 144.5 50.96 Favored Pre-proline 0 N--CA 1.456 -0.168 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.225 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.44 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.6 Cg_exo -54.32 148.87 39.81 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 121.882 1.722 . . . . 0.0 110.894 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_endo -47.85 -53.81 6.07 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.135 1.89 . . . . 0.0 113.056 -178.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.75 -25.9 68.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.836 0.351 . . . . 0.0 111.151 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.79 -47.21 26.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.676 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.659 ' HD1' ' CD2' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -76.11 -22.96 54.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.806 -179.223 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.34 60.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.807 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.0 -15.17 63.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.772 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.39 -16.27 46.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.982 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.31 140.86 29.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.13 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.927 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.483 0.905 0 N-CA-C 111.231 -0.334 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.461 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 73.1 mt -66.15 -18.47 65.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.24 -33.52 58.98 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.254 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.595 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 66.4 m -56.78 -50.94 85.1 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.595 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 32.9 Cg_exo -58.16 -29.4 87.25 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.904 1.736 . . . . 0.0 112.296 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.02 -47.52 68.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.656 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 86.2 t80 -64.95 -42.43 94.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 179.829 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.91 -30.98 72.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.966 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.8 -44.14 64.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.021 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.0 mtt -65.8 -33.91 76.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.738 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.62 -42.3 95.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.579 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.667 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 66.9 t80 -58.66 -44.54 90.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.379 179.713 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.7 -37.38 86.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.235 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -66.44 -30.29 70.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.603 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -74.25 -32.28 62.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.665 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -76.24 -39.59 54.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -70.22 -31.91 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.08 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -71.49 -37.95 71.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.855 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.49 -40.72 85.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -49.2 74.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.806 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.406 ' O ' HG23 ' A' ' 25' ' ' VAL . 12.0 pt-20 -64.44 -39.73 94.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.748 0.308 . . . . 0.0 111.729 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.538 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.4 m-20 -63.2 -53.66 49.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.949 0.404 . . . . 0.0 110.695 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.3 mt -49.05 -56.06 10.18 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.453 HG21 ' N ' ' A' ' 26' ' ' VAL . 33.5 m -53.09 -45.96 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.453 ' N ' HG21 ' A' ' 25' ' ' VAL . 27.8 m -74.4 -35.98 40.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.146 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.538 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 91.2 mt -66.99 -23.08 65.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.049 0.452 . . . . 0.0 109.906 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.25 -31.02 69.28 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.697 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.06 -31.6 64.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.214 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.59 74.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -65.22 -42.18 93.71 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.241 179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.697 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.4 p -62.46 -39.65 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.6 -43.69 97.12 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.393 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.445 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.27 -49.57 76.29 Favored Glycine 0 C--N 1.332 0.331 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.559 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.05 -21.68 66.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.047 -0.576 . . . . 0.0 110.279 178.383 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.524 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -74.59 -32.67 62.44 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.56 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.89 59.63 Favored Glycine 0 N--CA 1.433 -1.511 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.747 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.559 HG23 ' HA ' ' A' ' 35' ' ' ALA . 14.3 tt -77.45 -36.35 23.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.492 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.658 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.72 -38.75 58.29 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.658 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.9 -38.35 79.55 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -178.793 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 12.3 m-85 -77.84 -34.69 51.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.556 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.67 -47.23 80.26 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.933 0.873 . . . . 0.0 108.843 176.413 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.3 t -70.16 -54.21 19.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.816 -1.083 . . . . 0.0 112.266 -179.06 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -76.88 -54.38 6.67 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.959 1.837 . . . . 0.0 115.959 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.529 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.02 -45.63 56.62 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 113.951 -1.477 . . . . 0.0 114.48 -175.44 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.466 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 24.9 t -55.95 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.477 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 49.73 -147.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.509 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.46 12.62 10.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.824 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -91.05 -29.6 17.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.892 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.601 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 0.9 OUTLIER -69.01 -22.31 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.518 -179.098 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.509 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.7 pt -66.81 -29.7 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -54.83 -35.93 64.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.38 31.72 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.078 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.48 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.2 ttm180 -122.87 98.85 6.09 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.714 0.769 . . . . 0.0 110.208 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 58' ' ' GLY . 72.9 mt -75.19 -20.0 59.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.724 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -26.44 -54.49 0.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.412 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.614 ' HD3' ' HB2' ' A' ' 56' ' ' ALA . 75.4 Cg_exo -52.02 -45.44 38.83 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.562 1.508 . . . . 0.0 111.972 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -48.02 46.03 Favored Glycine 0 CA--C 1.504 -0.595 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.4 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -36.94 85.76 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.967 -0.617 . . . . 0.0 111.444 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -64.66 -35.07 79.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.177 0.513 . . . . 0.0 109.968 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.593 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.76 -48.98 33.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.086 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.914 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.671 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.3 t80 -71.27 -55.42 8.09 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.759 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.89 -23.96 48.57 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.692 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.09 -30.56 46.18 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.174 -1.012 . . . . 0.0 111.658 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.422 HG23 HD21 ' A' ' 70' ' ' LEU . 1.7 p -90.26 -29.94 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.394 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.671 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.93 -52.44 46.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.153 179.058 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.759 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.1 Cg_endo -64.61 -40.06 24.82 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 123.053 2.502 . . . . 0.0 112.441 -178.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -56.71 18.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.533 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.422 HD21 HG23 ' A' ' 66' ' ' VAL . 4.5 mm? -58.61 -53.27 60.2 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.622 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.4 mt -49.48 -51.8 33.59 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.2 tp -58.28 -45.58 87.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.382 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.536 HD23 ' HB2' ' A' ' 81' ' ' TYR . 51.4 mt -69.87 -38.05 76.29 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.48 -20.0 37.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.093 0.473 . . . . 0.0 110.426 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.422 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -94.37 -7.24 42.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.767 178.452 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.534 ' HG ' ' HB1' ' A' ' 80' ' ' ALA . 15.8 tp -102.04 134.99 19.76 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.131 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.489 ' HD2' HD13 ' A' ' 76' ' ' LEU . 90.8 Cg_exo -44.81 145.35 2.93 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.573 2.182 . . . . 0.0 112.499 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.421 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 47.8 Cg_exo -55.66 -47.11 27.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.488 2.125 . . . . 0.0 112.843 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -65.05 -25.19 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.938 0.399 . . . . 0.0 111.011 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.534 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.76 -48.74 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.363 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.668 ' HE2' ' CE1' ' A' ' 81' ' ' TYR . 0.3 OUTLIER -73.88 -25.82 60.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.835 0.35 . . . . 0.0 110.782 -179.393 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.83 -49.25 40.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.78 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.51 -17.73 64.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.937 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -76.28 -26.26 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.116 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.3 140.07 44.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.339 -0.839 . . . . 0.0 110.891 -179.919 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 111.114 -0.379 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.33 -18.85 62.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.781 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.17 -33.7 58.97 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.267 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.451 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 43.3 t -52.29 -51.19 74.52 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.451 ' HD2' ' N ' ' A' ' 5' ' ' SER . 51.6 Cg_endo -69.62 -28.96 25.27 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.964 1.776 . . . . 0.0 112.444 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.72 -53.52 46.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.64 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 89.6 t80 -64.08 -41.69 97.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.996 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.14 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.32 68.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.384 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.0 mtp -68.33 -30.13 69.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.35 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.09 -46.75 70.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.338 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.34 -37.61 83.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.883 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -68.51 -44.69 74.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.57 -43.47 98.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.757 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.64 -28.67 69.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.452 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -74.93 -41.73 59.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.641 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -67.83 -34.61 77.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.72 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.16 -33.58 74.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.541 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -69.11 -54.26 15.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.025 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.457 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.32 -40.89 68.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.681 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' N ' HD21 ' A' ' 21' ' ' LEU . 11.2 pt-20 -71.77 -32.49 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.779 0.323 . . . . 0.0 111.163 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.57 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 84.2 m-20 -66.96 -54.49 21.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.945 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.0 mt -53.46 -51.28 63.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.41 HG21 ' N ' ' A' ' 26' ' ' VAL . 27.7 m -52.77 -46.11 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.331 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' N ' HG21 ' A' ' 25' ' ' VAL . 9.6 p -75.73 -37.15 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.849 0.357 . . . . 0.0 111.163 -179.877 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.57 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 97.0 mt -66.96 -22.67 65.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.017 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.54 -29.86 68.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -73.56 -33.16 64.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.366 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -42.79 75.1 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.5 t -65.49 -40.61 93.26 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.088 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.623 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.25 -40.67 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.541 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.43 -42.57 96.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.271 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.441 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.85 -49.6 74.23 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.561 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -67.48 -19.63 65.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.045 -0.577 . . . . 0.0 110.509 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.528 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -77.74 -31.65 52.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.606 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.3 -32.14 58.43 Favored Glycine 0 N--CA 1.432 -1.573 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.41 178.417 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.592 ' O ' HD11 ' A' ' 42' ' ' LEU . 13.9 tt -78.05 -36.09 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.393 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.67 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.37 -35.92 54.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.67 ' N ' HD13 ' A' ' 39' ' ' LEU . 56.4 p -71.38 -35.17 70.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.189 0.519 . . . . 0.0 110.5 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.669 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 18.1 m-30 -79.49 -35.36 40.31 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.279 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.592 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -55.86 -46.72 78.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.765 0.793 . . . . 0.0 108.924 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.416 HG21 ' N ' ' A' ' 44' ' ' PHE . 35.0 m -72.42 -46.16 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.243 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 44' ' ' PHE . 1.8 m-85 -76.59 -53.91 7.4 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.653 ' HE1' ' CE2' ' A' ' 45' ' ' PHE . 9.3 m-85 -77.84 -48.7 15.86 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.483 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -54.44 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.233 -174.941 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.79 -145.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.445 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 8.31 9.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.941 0.401 . . . . 0.0 110.496 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.9 m95 -91.28 -26.76 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.651 ' HD2' ' CD1' ' A' ' 50' ' ' TYR . 1.4 p90 -63.8 -34.12 77.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.568 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.445 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.4 pt -56.49 -26.97 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -52.48 -48.73 65.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.235 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 173.15 49.76 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.073 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.562 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.8 ptt180 -156.21 102.02 2.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.535 0.683 . . . . 0.0 111.856 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' A' ' 56' ' ' ALA . 38.7 mt -73.91 -18.23 60.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.207 178.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.566 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.23 -53.79 0.17 Allowed Pre-proline 0 N--CA 1.463 0.224 0 O-C-N 123.691 0.619 . . . . 0.0 112.388 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.727 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 83.7 Cg_exo -47.61 -51.12 10.22 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.271 1.314 . . . . 0.0 111.87 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.62 -50.0 26.08 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 115.858 -0.61 . . . . 0.0 113.694 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.83 96.37 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.191 -0.504 . . . . 0.0 111.847 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.408 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -60.42 -34.08 73.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.632 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -75.03 -51.62 13.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.523 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.32 79.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.589 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.695 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.3 t80 -71.29 -55.28 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.533 -178.807 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.63 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.4 OUTLIER -77.71 -23.82 49.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -80.27 -29.78 44.0 Favored Glycine 0 N--CA 1.454 -0.142 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.616 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.29 -30.29 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.216 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.695 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.69 -51.29 61.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.314 179.208 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.782 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 48.2 Cg_endo -64.94 -39.75 23.57 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 122.814 2.343 . . . . 0.0 111.992 -178.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 73' ' ' LEU . 1.5 tm? -57.56 -57.51 12.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.123 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' HD22 ' A' ' 74' ' ' LEU . 4.4 mm? -57.09 -52.03 66.92 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.432 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.03 -50.96 45.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -58.28 -45.57 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.533 -179.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.522 HD11 HD11 ' A' ' 69' ' ' LEU . 10.8 mp -71.34 -37.88 71.68 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -81.48 -23.58 37.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.01 0.433 . . . . 0.0 110.263 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.0 -6.04 56.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.336 0.589 . . . . 0.0 109.613 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.566 HD11 ' HD2' ' A' ' 77' ' ' PRO . 15.8 tp -101.73 133.07 20.99 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.003 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.566 ' HD2' HD11 ' A' ' 76' ' ' LEU . 69.7 Cg_exo -41.54 142.74 1.11 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.55 2.166 . . . . 0.0 112.582 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.411 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 51.1 Cg_exo -53.8 -48.57 21.08 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.53 2.154 . . . . 0.0 113.09 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.54 -25.14 67.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.926 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.507 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.67 -47.83 24.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.411 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -75.12 -25.45 58.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.807 0.337 . . . . 0.0 110.621 -179.61 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.2 -47.25 65.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.715 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.51 -18.03 64.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.769 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.3 -23.08 40.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.854 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.3 137.09 54.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.921 -179.847 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.483 0.901 0 N-CA-C 111.124 -0.375 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 85.3 mt -70.9 -18.65 62.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.994 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.9 -33.61 59.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.973 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.492 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 45.7 t -55.97 -51.1 83.21 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.492 ' HD2' ' N ' ' A' ' 5' ' ' SER . 35.0 Cg_endo -65.0 -33.47 51.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 121.971 1.781 . . . . 0.0 112.609 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.42 -43.27 86.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.017 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.607 ' HD1' ' CD2' ' A' ' 8' ' ' PHE . 42.7 t80 -70.93 -40.31 72.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.992 -179.804 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.8 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.368 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.78 -34.76 69.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.173 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.3 tpp -67.62 -41.24 84.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.42 -32.09 73.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.133 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.602 ' HD1' ' CD2' ' A' ' 13' ' ' TYR . 78.0 t80 -66.55 -48.1 70.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.909 -179.819 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.71 -44.13 96.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.797 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.06 -32.83 74.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . 0.439 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.5 t70 -68.24 -37.64 81.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.459 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.86 -31.06 59.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.97 -43.85 70.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.439 ' NZ ' ' HA ' ' A' ' 16' ' ' ASP . 9.2 ptpp? -65.55 -32.91 74.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.748 0.309 . . . . 0.0 111.021 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.38 -51.26 54.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.452 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.68 -47.1 77.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.902 -179.733 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.452 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.6 pt-20 -66.55 -37.16 84.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.749 0.309 . . . . 0.0 111.671 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.443 ' O ' HD11 ' A' ' 27' ' ' LEU . 5.8 m-20 -65.22 -43.52 91.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.237 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.56 -54.89 39.95 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.411 HG21 ' N ' ' A' ' 26' ' ' VAL . 30.2 m -52.39 -45.41 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -177.615 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.558 HG12 HD11 ' A' ' 27' ' ' LEU . 7.4 p -74.51 -38.18 45.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 120.679 0.276 . . . . 0.0 110.806 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.558 HD11 HG12 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -63.66 -24.54 67.83 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.35 -32.57 73.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.638 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.59 -32.12 67.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.354 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -45.12 69.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.46 0.648 . . . . 0.0 109.367 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.433 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 58.1 m -64.43 -39.44 93.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.31 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.638 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.89 -41.68 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.052 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.507 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.59 -43.48 93.67 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 178.943 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.444 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -61.49 -49.53 76.1 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.55 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.94 -21.84 66.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.429 178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.529 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.4 m-70 -76.29 -31.97 58.52 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.65 -32.58 59.23 Favored Glycine 0 N--CA 1.434 -1.461 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.898 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.6 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.1 tt -78.44 -36.51 20.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.363 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.684 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.03 -35.73 59.39 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.684 ' N ' HD13 ' A' ' 39' ' ' LEU . 36.1 p -69.78 -40.49 76.01 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.963 0.411 . . . . 0.0 110.881 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.668 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 12.5 m-85 -76.53 -33.45 58.58 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.803 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.6 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.5 -46.89 83.23 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.943 0.878 . . . . 0.0 108.852 176.305 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 97.9 t -70.27 -54.35 19.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.112 -179.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -76.25 -54.45 6.78 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.859 1.799 . . . . 0.0 115.859 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.609 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.98 -45.56 49.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.833 -1.53 . . . . 0.0 114.458 -175.361 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.642 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 18.1 t -58.63 -81.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.402 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 46.8 -147.33 0.17 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -117.64 10.63 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.963 0.411 . . . . 0.0 110.263 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -91.05 -24.99 19.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.306 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.611 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 1.4 p90 -68.97 -32.96 72.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.291 -179.128 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 pt -63.29 -28.03 44.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 110.618 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -53.84 -52.15 61.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.025 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.76 44.28 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.112 -1.042 . . . . 0.0 113.275 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.471 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 7.4 ptp180 -151.67 99.1 2.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.719 0.771 . . . . 0.0 111.45 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 58' ' ' GLY . 0.0 OUTLIER -72.48 -18.01 61.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.212 179.37 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.55 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.37 -52.77 0.17 Allowed Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -178.47 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.55 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 83.1 Cg_exo -48.76 -44.56 31.05 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.372 1.381 . . . . 0.0 112.173 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.438 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -47.75 47.35 Favored Glycine 0 CA--C 1.504 -0.597 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.274 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.31 90.6 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.846 -0.677 . . . . 0.0 111.308 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.478 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.79 -34.16 76.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.275 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.642 ' HH ' ' HB2' ' A' ' 46' ' ' CYS . 2.5 m-85 -75.31 -44.35 45.94 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.007 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.66 -39.19 88.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 1.625 ' HD2' ' CD1' ' A' ' 63' ' ' PHE . 8.9 m-85 -71.3 -54.7 9.94 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.765 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.71 -23.94 49.34 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.726 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.36 42.74 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 119.957 -1.116 . . . . 0.0 111.648 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.87 -26.11 5.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.645 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.55 -51.32 70.64 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.663 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.765 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 37.9 Cg_endo -63.19 -41.31 28.23 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 123.209 2.606 . . . . 0.0 112.256 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.411 HD11 HD11 ' A' ' 73' ' ' LEU . 1.4 tm? -56.68 -56.8 16.79 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.402 ' O ' HD22 ' A' ' 74' ' ' LEU . 4.5 mm? -57.32 -52.41 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.699 179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.9 mt -49.65 -52.99 26.94 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.54 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 31.4 tp -56.77 -45.34 82.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.411 HD11 HD11 ' A' ' 69' ' ' LEU . 11.1 mp -71.01 -38.6 72.64 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.402 HD22 ' O ' ' A' ' 70' ' ' LEU . 2.1 pp -81.46 -22.88 37.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.039 0.447 . . . . 0.0 110.436 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.48 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -92.18 -8.02 46.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.997 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.54 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.4 tp -78.95 146.2 67.57 Favored Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.47 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.496 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 54.5 Cg_exo -52.77 160.01 4.39 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.051 1.834 . . . . 0.0 111.365 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -54.19 -57.38 1.86 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.018 1.812 . . . . 0.0 113.199 -179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -62.83 -26.25 68.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.836 0.35 . . . . 0.0 111.213 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.85 -45.87 33.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.794 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -78.18 -24.3 47.25 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.669 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.25 -43.83 63.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.403 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.95 -15.6 63.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.92 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.73 -11.84 54.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.928 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.67 141.73 34.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.116 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.06 -179.902 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.485 0.984 0 N-CA-C 111.188 -0.351 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.429 ' C ' ' HD2' ' A' ' 6' ' ' PRO . 3.7 mm? -70.75 -17.58 62.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.13 -33.42 65.08 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.353 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.63 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 42.8 t -61.15 -51.38 79.01 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 117.067 0.433 . . . . 0.0 111.879 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 31.9 Cg_exo -59.58 -30.16 91.67 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.906 1.738 . . . . 0.0 111.56 178.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.52 -33.74 76.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.452 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.67 ' HD1' ' CD2' ' A' ' 8' ' ' PHE . 90.3 t80 -75.6 -35.98 60.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.602 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -30.54 63.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.69 -46.22 47.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.8 ptm -63.84 -31.8 73.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.82 -36.08 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.633 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 88.9 t80 -67.0 -34.31 77.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.576 179.701 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -70.09 -46.54 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -66.24 -33.96 76.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.947 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.49 -48.48 64.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.0 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.61 -35.2 80.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -69.72 -39.38 76.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.258 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -68.37 -37.01 80.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.081 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.522 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.71 -53.14 45.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.078 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -48.57 70.39 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.692 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -63.92 -31.26 72.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.944 0.402 . . . . 0.0 110.996 -179.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.427 ' O ' HD11 ' A' ' 27' ' ' LEU . 89.2 m-20 -67.64 -42.6 82.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.14 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.522 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -61.63 -50.91 70.65 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.42 HG21 ' N ' ' A' ' 26' ' ' VAL . 35.0 m -54.75 -41.74 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.917 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.42 ' N ' HG21 ' A' ' 25' ' ' VAL . 57.5 t -74.79 -41.8 47.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.746 179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.5 HD22 ' O ' ' A' ' 75' ' ' ALA . 0.6 OUTLIER -64.63 -20.6 66.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.372 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -70.89 -37.03 72.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.622 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.16 -32.4 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.801 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -45.6 68.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.232 0.539 . . . . 0.0 109.581 177.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.427 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 96.1 p -64.14 -38.2 90.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.2 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.622 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.61 -41.36 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.527 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -59.7 -42.81 93.84 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.425 179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' O ' ' HB3' ' A' ' 64' ' ' TYR . . . -61.94 -49.38 76.13 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 178.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.566 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -66.03 -20.7 66.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.063 -0.569 . . . . 0.0 110.281 178.256 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.529 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.6 m-70 -75.76 -31.75 59.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.12 -32.61 58.24 Favored Glycine 0 N--CA 1.434 -1.494 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.62 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.598 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.7 tt -77.86 -36.72 22.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.318 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.652 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.83 -37.78 58.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.652 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.15 -38.28 78.7 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.922 0.391 . . . . 0.0 111.187 -178.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.475 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 11.4 m-85 -77.9 -33.61 51.84 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.418 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.598 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.1 mp -57.27 -47.37 81.62 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.8 t -70.16 -54.06 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.234 -179.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -76.23 -54.12 7.25 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.609 ' HD2' ' CD1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -74.84 -40.22 61.16 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 113.98 -1.464 . . . . 0.0 114.817 -175.197 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.429 ' SG ' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -67.95 9.28 0.31 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.282 0.492 . . . . 0.0 112.192 -178.549 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.51 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -43.92 153.52 0.13 Allowed 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 178.851 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.34 6.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.51 ' H ' ' C ' ' A' ' 47' ' ' ALA . 26.4 m95 -90.78 -23.11 20.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.723 0.297 . . . . 0.0 110.899 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 50' ' ' TYR . 0.8 OUTLIER -69.04 -22.41 64.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.176 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.5 pt -70.1 -29.41 39.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 0.0 110.99 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -54.74 -33.68 61.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.874 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.58 29.39 0.03 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.519 -0.848 . . . . 0.0 113.307 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.418 ' O ' ' CG ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -124.28 97.65 5.42 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.711 0.767 . . . . 0.0 110.583 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 58' ' ' GLY . 36.1 mt -74.56 -19.23 60.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.135 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.59 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.57 -53.63 0.18 Allowed Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -178.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.624 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 85.8 Cg_exo -48.77 -46.43 24.53 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.417 1.411 . . . . 0.0 111.987 178.706 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.35 -48.0 42.03 Favored Glycine 0 CA--C 1.506 -0.508 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.528 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.22 93.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.923 -0.638 . . . . 0.0 111.31 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.475 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -62.49 -34.91 77.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.131 0.491 . . . . 0.0 109.976 179.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.624 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.0 m-85 -73.89 -42.84 60.11 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.767 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.95 85.52 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.796 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.555 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.49 -55.1 8.54 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.594 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 1.6 m-85 -77.86 -24.22 48.63 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.98 -31.01 44.78 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.948 -1.12 . . . . 0.0 111.609 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.02 -27.88 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.115 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.641 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -49.39 -51.16 60.38 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.974 178.477 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.778 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.9 Cg_endo -64.4 -40.43 24.66 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 123.053 2.502 . . . . 0.0 112.232 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.471 HD11 HD11 ' A' ' 73' ' ' LEU . 1.8 tm? -57.6 -55.52 33.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' HD22 ' A' ' 74' ' ' LEU . 49.4 mt -55.58 -53.6 54.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.161 179.615 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -49.68 -52.53 30.35 Favored 'General case' 0 C--O 1.223 -0.31 0 O-C-N 123.403 0.439 . . . . 0.0 112.091 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.55 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 62.6 tp -57.39 -44.53 84.57 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.471 HD11 HD11 ' A' ' 69' ' ' LEU . 11.0 mp -71.42 -39.74 70.89 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.407 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.33 -23.97 37.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.379 -179.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.5 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -90.48 -7.36 53.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.722 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.55 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.8 tp -77.98 144.8 68.55 Favored Pre-proline 0 C--O 1.231 0.117 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.355 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.474 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 57.7 Cg_exo -52.52 156.14 8.99 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.117 1.878 . . . . 0.0 111.091 178.968 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -51.7 -58.25 1.71 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.081 1.854 . . . . 0.0 113.276 -179.016 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.58 -24.97 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.793 0.33 . . . . 0.0 111.187 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.53 -45.2 31.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.765 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -78.43 -25.26 45.96 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.521 -179.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.19 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -88.4 -10.74 48.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.956 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.2 154.26 22.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.093 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.92 -179.916 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.879 0 N-CA-C 111.19 -0.35 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.48 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 76.9 mt -71.42 -22.21 61.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.099 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.84 -33.79 57.15 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.25 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.58 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 68.6 m -53.23 -51.26 76.99 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.58 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 39.9 Cg_exo -57.3 -34.52 98.0 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.952 1.768 . . . . 0.0 112.274 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.56 -34.61 78.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.765 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -75.94 -40.44 54.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.12 83.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.13 64.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 47.3 ttm -72.13 -43.48 64.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.981 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -63.87 -37.87 88.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.634 ' HD2' ' CD1' ' A' ' 13' ' ' TYR . 69.8 t80 -59.94 -50.86 72.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.746 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -59.46 -38.18 80.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.699 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -66.32 -39.79 89.51 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.058 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -66.06 -41.96 90.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -70.67 -32.78 70.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.73 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.457 ' HA ' HD21 ' A' ' 21' ' ' LEU . 24.1 t70 -68.5 -40.29 80.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.431 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -68.48 -28.86 67.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.443 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -53.18 36.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.328 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.631 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.5 pp -59.31 -42.56 91.65 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.198 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.631 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -67.36 -42.98 82.58 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.357 -176.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.557 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.4 m-20 -63.14 -54.9 30.56 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.383 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.8 tp -51.95 -52.18 52.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.8 t -50.12 -49.85 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.1 t -72.57 -40.36 62.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.14 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 92.6 mt -63.68 -21.82 66.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.396 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.68 -31.08 67.85 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.636 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.89 -34.44 69.17 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.267 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.68 79.35 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.42 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -66.54 -39.89 88.81 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.157 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.636 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -65.57 -39.77 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.038 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.502 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.38 -43.06 96.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.166 178.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.78 -49.24 78.09 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.598 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.3 -23.07 66.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.255 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.528 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.8 m-70 -75.27 -31.97 60.91 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.568 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.83 -33.57 60.02 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.999 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.598 HG23 ' HA ' ' A' ' 35' ' ' ALA . 16.8 tt -78.52 -36.55 20.23 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.452 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.659 HD13 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.09 -35.85 59.18 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.659 ' N ' HD13 ' A' ' 39' ' ' LEU . 35.5 p -69.54 -39.69 77.33 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.014 0.435 . . . . 0.0 110.957 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.67 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 12.8 m-85 -77.93 -32.33 51.53 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.595 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.0 OUTLIER -57.3 -47.11 82.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.063 0.935 . . . . 0.0 108.565 176.22 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.4 t -70.05 -54.35 19.29 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.727 0 CA-C-N 114.691 -1.14 . . . . 0.0 112.074 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -77.2 -54.76 6.1 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.502 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -72.1 -38.29 69.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.839 -1.528 . . . . 0.0 114.374 -175.317 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.66 ' HB2' ' HH ' ' A' ' 61' ' ' TYR . 8.9 t -69.54 15.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.025 0.375 . . . . 0.0 111.886 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.524 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.85 156.13 0.77 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.48 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.62 7.43 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.524 ' H ' ' C ' ' A' ' 47' ' ' ALA . 29.4 m95 -90.55 -23.99 20.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.899 0.381 . . . . 0.0 110.742 178.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.407 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -68.11 -25.14 65.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.392 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 48' ' ' ALA . 39.7 pt -71.33 -29.43 35.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.662 0.267 . . . . 0.0 111.246 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -55.86 -35.75 66.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.818 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.58 32.28 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.101 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.457 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -128.43 98.08 4.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.724 0.773 . . . . 0.0 110.653 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 3.8 pp -75.28 -19.14 59.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.937 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.584 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.35 -54.29 0.17 Allowed Pre-proline 0 N--CA 1.467 0.381 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.584 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 88.6 Cg_exo -48.43 -45.23 27.5 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.321 1.347 . . . . 0.0 111.749 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.93 -48.49 45.21 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 115.752 -0.658 . . . . 0.0 113.276 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.13 -36.14 83.06 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.587 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -65.11 -35.57 81.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.189 0.519 . . . . 0.0 110.071 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.618 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 2.9 m-85 -72.82 -49.0 33.05 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.997 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.22 90.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.681 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.1 t80 -70.97 -55.26 8.72 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.596 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.6 OUTLIER -77.7 -24.19 49.28 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.11 -30.49 46.4 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.639 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.421 HG21 HD11 ' A' ' 70' ' ' LEU . 1.8 p -90.16 -29.65 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.137 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.681 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.28 -51.87 53.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.247 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.755 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.5 Cg_endo -64.89 -40.2 22.19 Favored 'Trans proline' 0 N--CA 1.448 -1.166 0 C-N-CA 123.015 2.476 . . . . 0.0 112.323 -178.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.08 -54.63 44.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 0.0 110.545 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.421 HD11 HG21 ' A' ' 66' ' ' VAL . 11.1 mp -57.37 -53.66 55.59 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.368 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.1 mt -50.64 -49.33 57.2 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.251 0.344 . . . . 0.0 111.8 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.517 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 45.9 tp -60.05 -43.21 95.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.7 mt -71.91 -38.55 69.89 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -82.16 -21.41 36.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.985 0.421 . . . . 0.0 110.311 179.779 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.416 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -92.13 -3.88 55.06 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.373 0.606 . . . . 0.0 109.779 178.343 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.517 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 1.5 tp -85.97 148.14 47.33 Favored Pre-proline 0 CA--C 1.528 0.099 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.964 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.501 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.3 Cg_exo -54.19 159.14 8.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 121.937 1.758 . . . . 0.0 111.273 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . 0.408 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 17.4 Cg_endo -57.38 -57.17 1.36 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.004 1.803 . . . . 0.0 112.97 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -62.48 -26.7 68.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.108 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.92 -45.98 32.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.925 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.408 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.6 OUTLIER -76.98 -25.41 52.73 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.905 -178.868 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.89 -47.8 57.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.694 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.91 -13.73 62.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.148 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.47 -16.76 41.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.083 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.15 143.55 26.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.216 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 65.7 p . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.773 179.858 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . 0.406 ' H ' ' H ' ' A' ' 3' ' ' LEU . 3.7 Cg_exo . . . . . 0 N--CA 1.483 0.887 0 N-CA-C 111.091 -0.388 . . . . 0.0 111.091 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.416 HD23 ' N ' ' A' ' 3' ' ' LEU . 3.3 mm? -71.35 -18.71 62.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.118 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.85 -33.69 59.85 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.206 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.493 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 53.1 m -56.79 -50.85 85.63 Favored Pre-proline 0 CA--C 1.537 0.453 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.493 ' HD2' ' N ' ' A' ' 5' ' ' SER . 31.5 Cg_endo -65.1 -28.22 56.93 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.034 1.823 . . . . 0.0 112.686 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.03 -57.61 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.363 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -65.88 -31.41 72.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.276 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.94 -46.14 68.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.203 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.87 -37.15 86.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -67.16 -28.59 68.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.6 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -67.42 -40.2 85.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -65.04 -31.75 73.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -50.68 39.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.835 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.15 -28.94 69.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.02 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.56 -48.65 54.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.03 -34.51 76.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.097 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -67.79 -46.56 71.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.168 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.561 ' HZ1' HD22 ' A' ' 23' ' ' ASN . 60.5 tttm -62.38 -38.25 88.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 -179.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.557 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -64.81 -50.67 65.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.154 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.431 HD21 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.0 -48.78 70.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.635 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.431 ' N ' HD21 ' A' ' 21' ' ' LEU . 12.5 pt-20 -65.04 -31.23 72.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.561 HD22 ' HZ1' ' A' ' 19' ' ' LYS . 93.3 m-20 -65.78 -46.38 78.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.339 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -60.94 -52.44 65.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 33.7 m -53.57 -42.6 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.254 -177.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.28 -41.76 43.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.382 . . . . 0.0 110.915 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.549 HD22 ' O ' ' A' ' 75' ' ' ALA . 0.7 OUTLIER -64.25 -21.93 66.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.4 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -70.07 -30.66 67.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.63 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -74.59 -34.4 62.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.66 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.19 -42.73 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.281 0.562 . . . . 0.0 109.525 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.0 t -65.39 -41.43 93.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.63 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -62.54 -41.09 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.086 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.512 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.97 -42.06 97.59 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.455 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.27 -50.17 67.53 Favored Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.558 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -67.23 -20.1 65.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.113 -0.543 . . . . 0.0 110.184 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.527 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.3 m-70 -76.48 -32.27 58.25 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.32 -33.09 59.3 Favored Glycine 0 N--CA 1.43 -1.7 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.429 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.588 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.2 tt -77.08 -37.2 25.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.468 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.648 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.82 -37.24 59.27 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.648 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -72.71 -33.43 66.44 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.919 0.39 . . . . 0.0 110.853 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.632 ' HE2' ' CE1' ' A' ' 41' ' ' PHE . 14.7 m-85 -79.7 -35.06 39.61 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.822 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.588 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.26 -45.83 79.89 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.747 0.784 . . . . 0.0 108.923 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.8 m -72.59 -45.47 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.168 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 0.479 ' HB2' ' O ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -76.15 -54.0 7.46 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.208 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.722 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 8.7 m-85 -78.68 -49.08 13.77 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.494 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -57.07 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.516 -0.874 . . . . 0.0 111.562 -175.41 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' CYS . . . 38.27 -139.51 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.441 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.88 18.75 10.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.956 0.408 . . . . 0.0 110.561 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -90.37 -37.15 14.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.824 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.42 ' CB ' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.17 -15.24 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.069 -179.484 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.441 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -58.62 -28.87 37.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.865 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -54.45 -29.96 51.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.821 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.73 26.08 0.3 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.479 -0.867 . . . . 0.0 113.357 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.409 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.5 OUTLIER -110.97 105.74 14.62 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.263 0.554 . . . . 0.0 110.244 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 56' ' ' ALA . 50.8 mt -74.31 -18.87 60.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.16 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.555 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -25.47 -52.17 0.17 Allowed Pre-proline 0 N--CA 1.468 0.428 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.722 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 88.1 Cg_exo -49.88 -49.67 15.39 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 121.728 1.618 . . . . 0.0 112.055 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.41 -49.36 26.25 Favored Glycine 0 CA--C 1.506 -0.503 0 CA-C-N 115.943 -0.572 . . . . 0.0 114.014 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.32 99.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.171 -0.515 . . . . 0.0 111.734 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.459 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.5 -34.84 73.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.24 0.543 . . . . 0.0 110.164 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.639 ' HE1' ' CE2' ' A' ' 61' ' ' TYR . 3.6 m-30 -74.39 -44.36 52.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.169 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.17 86.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.673 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.601 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.1 m-85 -71.4 -54.77 9.61 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -77.73 -24.19 49.16 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.414 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -78.62 -31.42 45.21 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.605 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 p -91.8 -24.69 5.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.646 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.82 -50.53 77.28 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.714 178.297 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.0 Cg_endo -63.62 -39.75 33.62 Favored 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.923 2.415 . . . . 0.0 111.882 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -57.41 -58.15 9.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.185 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.411 ' O ' HD22 ' A' ' 74' ' ' LEU . 10.8 mp -55.29 -52.84 62.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.451 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.7 mt -49.78 -52.54 31.18 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.327 0.392 . . . . 0.0 112.041 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 46.9 tp -56.83 -45.41 82.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.717 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -70.47 -38.98 74.51 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.566 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.411 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.02 -20.9 37.44 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.049 0.452 . . . . 0.0 110.452 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.549 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -93.55 -12.07 30.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.55 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 2.4 tp -73.42 150.6 89.4 Favored Pre-proline 0 N--CA 1.456 -0.164 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.322 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.55 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.9 Cg_exo -52.91 160.71 3.84 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.009 1.806 . . . . 0.0 111.206 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 25.5 Cg_endo -61.74 -56.24 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 121.884 1.723 . . . . 0.0 112.793 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -63.95 -26.05 68.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 111.109 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.78 -47.19 26.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.691 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -76.7 -24.93 53.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.691 -179.035 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.2 -42.95 65.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.29 -18.24 64.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.765 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.53 -22.2 44.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.884 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.36 131.54 41.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.189 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.2 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.934 179.979 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.483 0.906 0 N-CA-C 111.15 -0.365 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.462 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 6.7 mp -71.15 -17.95 62.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.812 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.93 -33.96 59.37 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.973 -0.632 . . . . 0.0 113.491 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.588 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 69.3 m -55.87 -51.14 82.81 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.588 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 51.9 Cg_exo -56.15 -34.93 94.41 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.053 1.836 . . . . 0.0 112.374 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.22 -44.4 95.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.82 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.654 ' HE2' ' CE1' ' A' ' 8' ' ' PHE . 82.5 t80 -67.6 -31.37 71.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.848 179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.91 -38.41 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.156 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.41 -41.75 84.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.028 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 95.6 mmm -66.05 -34.28 77.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -62.67 -37.84 88.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.648 ' HE2' ' CE1' ' A' ' 13' ' ' TYR . 76.1 t80 -65.6 -36.04 82.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -69.71 -48.02 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.999 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -66.13 -32.22 73.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.968 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.71 -49.49 52.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.57 -34.11 77.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.69 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.492 ' HA ' HD21 ' A' ' 21' ' ' LEU . 21.9 t70 -64.45 -49.86 69.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.56 -28.61 69.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.783 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.545 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.11 -56.68 8.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.555 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.681 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.2 pp -54.93 -43.97 73.81 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.508 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.681 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 12.8 pt-20 -67.35 -34.01 76.44 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -177.188 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.492 ' O ' HD12 ' A' ' 27' ' ' LEU . 10.5 m120 -67.71 -54.79 16.56 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.96 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.545 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.8 mt -53.52 -49.95 66.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.463 HG11 ' O ' ' A' ' 21' ' ' LEU . 19.6 m -53.68 -42.04 49.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -177.426 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.589 HG11 HD11 ' A' ' 27' ' ' LEU . 7.2 p -82.02 -39.13 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.425 0.155 . . . . 0.0 111.369 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.589 HD11 HG11 ' A' ' 26' ' ' VAL . 10.4 mp -61.69 -27.86 69.0 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.77 -38.11 82.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.925 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.65 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -68.5 -31.91 71.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.739 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.491 ' HB3' HD11 ' A' ' 71' ' ' LEU . . . -69.69 -42.38 74.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.342 0.592 . . . . 0.0 109.7 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.417 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 34.0 t -67.42 -36.64 81.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.315 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.65 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -67.82 -44.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.075 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.45 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.86 -44.1 97.47 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.838 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.411 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.92 -49.62 73.79 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.314 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.542 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -66.72 -20.29 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.276 -0.462 . . . . 0.0 110.208 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.504 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.6 m-70 -76.12 -32.24 59.06 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -33.05 58.71 Favored Glycine 0 N--CA 1.435 -1.425 0 CA-C-N 114.265 -1.334 . . . . 0.0 110.854 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.553 ' O ' HD21 ' A' ' 42' ' ' LEU . 14.5 tt -77.4 -37.44 25.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.383 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.637 HD13 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.58 -38.1 59.4 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.268 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.637 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.2 -37.78 78.29 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 120.804 0.335 . . . . 0.0 110.982 -178.812 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.458 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 11.7 m-85 -78.21 -32.69 50.02 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.515 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.553 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -58.1 -46.79 84.93 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 176.262 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.4 t -69.93 -53.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.047 -179.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.657 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 8.6 m-85 -76.11 -54.91 6.13 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -177.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.624 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -74.78 -45.42 43.79 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.828 -1.533 . . . . 0.0 114.48 -175.236 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.503 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.46 -81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.122 0.419 . . . . 0.0 111.615 -178.638 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 50.35 -146.39 0.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.493 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.03 9.08 9.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.092 0.472 . . . . 0.0 110.616 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -91.13 -26.53 19.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.208 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 1.585 ' HE2' ' CE1' ' A' ' 50' ' ' TYR . 1.1 p90 -67.74 -23.39 65.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.455 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.493 HG12 ' O ' ' A' ' 48' ' ' ALA . 32.3 pt -70.66 -28.5 34.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.884 0.373 . . . . 0.0 110.702 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.58 ' HZ1' ' HB3' ' A' ' 52' ' ' LYS . 5.3 ttpm? -54.08 -29.55 44.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.913 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.26 37.53 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.594 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.514 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -133.96 97.79 3.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.817 0.818 . . . . 0.0 110.731 -179.954 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.61 -19.78 58.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.452 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.576 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -26.31 -54.68 0.2 Allowed Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.598 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 71.0 Cg_exo -50.43 -43.38 44.72 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 121.645 1.563 . . . . 0.0 112.037 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.47 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.8 -46.3 48.6 Favored Glycine 0 CA--C 1.507 -0.467 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.364 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.23 86.11 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.519 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.458 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -65.88 -31.07 71.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.598 ' HH ' ' HB3' ' A' ' 57' ' ' PRO . 3.8 m-30 -77.15 -45.23 27.48 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.926 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.93 -38.95 87.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.716 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 1.669 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 18.6 t80 -71.18 -55.04 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 1.634 ' HE1' ' CE2' ' A' ' 64' ' ' TYR . 0.7 OUTLIER -77.9 -23.34 48.72 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.54 -28.99 50.48 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 119.867 -1.159 . . . . 0.0 111.652 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -91.66 -30.12 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.662 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.32 -49.84 68.26 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.992 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.1 Cg_endo -64.83 -39.09 27.07 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.93 2.42 . . . . 0.0 112.01 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.14 -54.81 42.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.437 ' O ' HD22 ' A' ' 74' ' ' LEU . 4.6 mm? -56.52 -50.8 70.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.767 179.068 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.491 HD11 ' HB3' ' A' ' 30' ' ' ALA . 72.0 mt -51.0 -51.09 56.49 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.351 0.407 . . . . 0.0 111.977 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.58 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 8.8 tt -59.99 -40.4 89.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.684 0.278 . . . . 0.0 111.487 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.2 tp -73.62 -40.52 63.73 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.1 pp -80.14 -28.47 38.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.594 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.504 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -86.34 -3.1 58.93 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.263 0.554 . . . . 0.0 109.518 178.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.58 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.4 tp -78.82 145.19 65.78 Favored Pre-proline 0 C--O 1.232 0.168 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.092 179.35 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.547 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 54.5 Cg_exo -51.91 155.99 7.65 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 121.829 1.686 . . . . 0.0 110.858 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -55.06 -58.13 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 121.888 1.725 . . . . 0.0 113.066 -179.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -62.64 -27.28 69.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.917 0.389 . . . . 0.0 111.238 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.19 -45.77 31.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.976 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.447 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.688 -178.8 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.53 65.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.385 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.91 -16.72 63.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -81.85 -15.99 52.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.934 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.73 137.17 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.135 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 53.3 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.295 -0.859 . . . . 0.0 110.911 -179.947 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.869 0 N-CA-C 111.209 -0.343 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.44 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 71.3 mt -71.6 -18.71 62.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.235 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.84 -33.61 59.96 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.466 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.585 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 71.0 m -60.58 -50.42 85.54 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.585 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 27.3 Cg_exo -62.47 -50.09 4.94 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.125 1.884 . . . . 0.0 113.12 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.19 -38.1 82.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.702 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -75.09 -39.26 60.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.767 0.317 . . . . 0.0 111.163 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.87 -41.38 95.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.4 -37.1 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.831 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.0 ttm -68.0 -34.18 76.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.94 -41.7 97.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.615 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 75.0 t80 -60.62 -36.34 78.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.315 179.69 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -69.41 -40.82 77.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.839 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -66.43 -46.64 75.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.192 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.14 -27.61 68.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.236 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.32 -43.2 33.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.941 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.47 -33.52 74.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -69.47 -38.29 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.573 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.26 -53.98 36.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.822 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -49.25 68.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -64.35 -31.53 72.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 0.0 111.057 -179.29 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.572 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -66.43 -54.1 28.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.167 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.573 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 1.0 OUTLIER -53.58 -50.08 66.37 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.422 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.421 HG21 ' N ' ' A' ' 26' ' ' VAL . 35.5 m -53.83 -44.98 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.421 ' N ' HG21 ' A' ' 25' ' ' VAL . 27.5 m -76.28 -37.25 31.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.125 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 93.0 mt -66.83 -20.41 65.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.102 0.477 . . . . 0.0 109.889 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -70.79 -31.21 67.9 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.625 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.95 -33.78 66.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.251 178.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.48 -41.53 76.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.8 t -66.25 -40.53 90.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.083 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.625 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -63.39 -38.79 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.52 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -61.26 -41.39 96.85 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.31 178.612 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.467 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.73 71.57 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.574 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -66.96 -20.71 65.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.133 -0.533 . . . . 0.0 110.164 178.217 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.5 m-70 -74.94 -33.3 61.93 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.601 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.81 -33.3 60.32 Favored Glycine 0 N--CA 1.431 -1.673 0 CA-C-N 113.98 -1.464 . . . . 0.0 110.393 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.583 ' O ' HD11 ' A' ' 42' ' ' LEU . 13.1 tt -78.05 -35.59 20.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.695 -179.744 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.636 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.8 -37.57 55.54 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.636 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -73.06 -33.24 65.55 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.851 0.358 . . . . 0.0 111.024 -179.107 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.467 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 15.5 m-30 -79.48 -35.39 40.3 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.927 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.583 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -56.36 -46.18 80.12 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.79 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.04 -46.11 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.1 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.663 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 1.5 m-85 -76.52 -54.37 6.8 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.715 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 11.1 m-85 -77.31 -48.78 16.49 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -176.184 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.486 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 49.0 t -56.05 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.763 -175.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 42.63 -143.42 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.96 12.83 9.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.549 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.58 ' HB3' HH21 ' A' ' 54' ' ' ARG . 25.8 m95 -90.66 -32.44 16.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.584 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.425 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -63.96 -11.7 30.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.818 0.342 . . . . 0.0 111.313 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.6 pt -65.25 -27.59 42.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.658 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -52.67 -43.26 65.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.179 -178.892 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.43 38.74 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.254 -0.974 . . . . 0.0 112.997 179.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.58 HH21 ' HB3' ' A' ' 49' ' ' TRP . 16.0 ptt180 -132.29 102.4 5.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.508 0.671 . . . . 0.0 111.492 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 58' ' ' GLY . 35.0 mt -73.32 -17.48 61.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.048 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.522 ' HB2' ' HD3' ' A' ' 57' ' ' PRO . . . -24.98 -52.55 0.16 Allowed Pre-proline 0 N--CA 1.465 0.302 0 O-C-N 123.768 0.667 . . . . 0.0 112.52 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.715 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.8 Cg_exo -48.25 -51.16 10.59 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.35 1.367 . . . . 0.0 111.798 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.82 -49.17 29.1 Favored Glycine 0 CA--C 1.509 -0.34 0 CA-C-N 115.978 -0.556 . . . . 0.0 113.896 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.09 99.7 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.063 -0.568 . . . . 0.0 111.776 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.467 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -59.78 -35.22 74.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.279 0.562 . . . . 0.0 110.219 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 0.623 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.3 m-30 -73.45 -45.79 52.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.119 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.54 -38.32 89.29 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.8 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 1.665 ' HE1' ' CE2' ' A' ' 63' ' ' PHE . 10.5 m-85 -71.39 -54.49 10.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.781 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.69 -24.02 49.4 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . 0.481 ' HA3' HD13 ' A' ' 38' ' ' ILE . . . -78.99 -31.67 42.52 Favored Glycine 0 CA--C 1.516 0.147 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.481 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -89.93 -27.44 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.139 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.664 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.28 -51.75 60.41 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.95 178.795 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.781 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.7 Cg_endo -62.37 -42.95 25.05 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 123.157 2.571 . . . . 0.0 112.143 -178.5 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -57.17 -55.31 36.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.424 ' O ' HD22 ' A' ' 74' ' ' LEU . 88.2 mt -57.89 -55.3 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.399 -179.684 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.61 HD13 ' N ' ' A' ' 72' ' ' LEU . 4.3 pp -55.16 -38.35 68.16 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.61 ' N ' HD13 ' A' ' 71' ' ' LEU . 47.6 tp -66.83 -44.42 81.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.688 0.28 . . . . 0.0 111.057 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 10.8 mp -70.97 -36.65 72.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.424 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.53 -23.82 34.37 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.113 179.705 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.42 -5.82 57.08 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HB1' ' A' ' 80' ' ' ALA . 19.2 tp -108.02 135.01 19.92 Favored Pre-proline 0 C--O 1.232 0.177 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.919 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.501 ' HD2' HD13 ' A' ' 76' ' ' LEU . 83.4 Cg_exo -45.12 141.21 6.81 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.305 2.003 . . . . 0.0 112.083 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.12 -41.76 75.46 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.477 2.118 . . . . 0.0 112.721 -179.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -67.48 -26.81 66.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.012 0.434 . . . . 0.0 110.418 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.535 ' HB1' ' HG ' ' A' ' 76' ' ' LEU . . . -75.07 -50.35 16.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.626 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.637 ' HE1' ' CE2' ' A' ' 81' ' ' TYR . 0.4 OUTLIER -72.74 -24.01 60.91 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-O 120.767 0.317 . . . . 0.0 111.019 -179.553 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.82 -49.94 40.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.876 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.69 -15.28 63.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.112 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.78 -14.89 46.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.081 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.26 162.35 19.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.995 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 53.2 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.973 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.482 0.852 0 N-CA-C 111.207 -0.343 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.95 -21.55 62.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.76 -34.0 59.84 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.193 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.463 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 48.2 t -54.58 -51.01 82.19 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.463 ' HD2' ' N ' ' A' ' 5' ' ' SER . 39.6 Cg_endo -67.35 -28.91 39.01 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.921 1.747 . . . . 0.0 112.805 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.1 -50.97 62.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.32 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -71.04 -31.16 67.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.67 -40.16 76.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.372 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.87 72.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.176 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.58 -40.32 88.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -62.16 -32.12 72.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.776 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.624 ' HE1' ' CE2' ' A' ' 13' ' ' TYR . 61.5 t80 -67.48 -39.95 85.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.568 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -67.34 -40.61 85.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.644 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.41 -40.79 89.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -64.12 -40.62 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.396 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.89 -34.58 75.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.443 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.474 ' HA ' HD21 ' A' ' 21' ' ' LEU . 16.2 t70 -67.18 -40.92 86.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.558 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.639 ' HB2' ' HZ3' ' A' ' 19' ' ' LYS . 10.5 mtmp? -66.74 -28.89 68.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.429 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.517 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.09 -56.62 9.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.187 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . 0.603 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.7 pp -55.51 -39.89 71.07 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 120.835 0.35 . . . . 0.0 110.978 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.603 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -69.38 -40.89 77.15 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.453 -176.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.598 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 m-20 -65.7 -55.28 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.476 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.517 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 7.3 mt -52.41 -51.6 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.051 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.449 HG21 ' N ' ' A' ' 26' ' ' VAL . 26.7 m -52.53 -44.55 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.215 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.449 ' N ' HG21 ' A' ' 25' ' ' VAL . 62.4 t -76.34 -40.97 35.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.687 0.279 . . . . 0.0 110.878 179.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.598 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 86.0 mt -63.9 -21.35 66.42 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.021 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -69.5 -32.96 72.16 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.679 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -72.33 -31.8 65.98 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.41 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.78 -44.0 71.02 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 38.6 t -65.05 -40.12 94.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.247 179.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.679 HG11 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.05 -40.59 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.08 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.74 98.86 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.681 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.417 ' HA2' ' HD2' ' A' ' 64' ' ' TYR . . . -62.16 -49.6 73.34 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.558 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -66.4 -20.15 65.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.277 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.546 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 m-70 -76.57 -32.11 57.95 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -32.57 59.29 Favored Glycine 0 N--CA 1.434 -1.483 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.653 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.595 ' O ' HD11 ' A' ' 42' ' ' LEU . 15.0 tt -77.68 -36.74 23.2 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.388 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.652 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.84 -37.62 58.84 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.652 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.88 -36.54 75.53 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 120.842 0.353 . . . . 0.0 111.061 -178.802 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 1.66 ' HE1' ' CE2' ' A' ' 41' ' ' PHE . 9.9 m-85 -79.53 -33.33 42.06 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.296 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.595 HD11 ' O ' ' A' ' 38' ' ' ILE . 1.1 mp -57.65 -47.34 82.53 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.759 0.79 . . . . 0.0 108.986 176.689 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 30.1 m -72.49 -50.8 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.329 -178.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.619 ' HE2' ' CE1' ' A' ' 44' ' ' PHE . 36.7 t80 -77.08 -54.25 6.77 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -177.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.639 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -74.02 -45.91 46.84 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 113.967 -1.469 . . . . 0.0 114.195 -175.666 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.522 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.8 t -60.04 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.197 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.72 -142.17 0.47 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.23 11.37 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.037 0.446 . . . . 0.0 110.564 178.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -90.92 -28.21 18.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.032 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.445 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 1.2 p90 -67.23 -24.64 65.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.4 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 20.2 pt -66.37 -27.45 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 0.0 110.61 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -53.52 -52.35 59.91 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.12 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 169.8 40.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.179 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.445 ' HG2' ' HA ' ' A' ' 50' ' ' TYR . 19.8 ptp180 -144.18 101.46 3.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.595 0.712 . . . . 0.0 111.425 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.477 HD11 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -73.25 -17.96 61.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.094 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.573 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.24 -54.05 0.17 Allowed Pre-proline 0 N--CA 1.468 0.433 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.632 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 85.1 Cg_exo -47.84 -46.41 21.61 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.321 1.348 . . . . 0.0 111.774 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.39 -46.67 44.81 Favored Glycine 0 CA--C 1.507 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.496 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.8 94.92 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.939 -0.631 . . . . 0.0 111.542 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.483 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -63.14 -34.82 78.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.962 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.631 ' HE1' ' CE2' ' A' ' 61' ' ' TYR . 3.1 m-30 -72.85 -44.53 61.27 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.656 179.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.9 88.45 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.857 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.656 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 5.7 m-85 -71.22 -54.96 9.15 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -178.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.753 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.76 -24.23 49.03 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.654 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.09 43.63 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.017 -1.087 . . . . 0.0 111.64 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.58 -26.78 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.656 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.84 -52.38 57.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.007 178.775 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.753 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.9 Cg_endo -64.76 -40.66 21.26 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 123.02 2.48 . . . . 0.0 112.501 -177.877 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.59 -55.65 32.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.199 179.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.438 ' O ' HD22 ' A' ' 74' ' ' LEU . 92.8 mt -56.6 -53.93 51.87 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.313 179.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.5 mt -49.99 -51.67 39.92 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.353 0.408 . . . . 0.0 111.839 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LEU . 65.1 tp -58.36 -46.83 85.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.32 -38.11 81.24 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.438 HD22 ' O ' ' A' ' 70' ' ' LEU . 2.1 pp -81.91 -21.91 37.1 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.126 0.489 . . . . 0.0 110.122 179.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.41 ' HB3' HD23 ' A' ' 27' ' ' LEU . . . -92.55 -5.76 51.01 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.596 178.464 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.439 ' HG ' ' HB2' ' A' ' 80' ' ' ALA . 21.3 tp -116.76 138.17 24.36 Favored Pre-proline 0 CA--C 1.53 0.185 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.186 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.403 ' HD2' HD13 ' A' ' 76' ' ' LEU . 54.2 Cg_exo -53.38 134.63 58.05 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.891 1.727 . . . . 0.0 111.465 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.06 -34.43 67.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.635 2.224 . . . . 0.0 112.579 -179.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.6 tpm_? -67.45 -29.46 68.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.407 179.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.439 ' HB2' ' HG ' ' A' ' 76' ' ' LEU . . . -73.19 -54.53 8.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.191 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -64.48 -31.02 72.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.89 84.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.665 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.53 -15.78 63.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.98 -18.03 51.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.812 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.46 130.91 38.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.85 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.009 -179.87 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.896 0 N-CA-C 111.192 -0.349 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.504 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 2.5 pt? -66.93 -18.56 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.031 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.74 -33.67 57.59 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.124 -0.56 . . . . 0.0 113.358 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.595 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 45.5 t -52.58 -50.83 78.32 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.595 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 51.6 Cg_exo -55.52 -31.82 80.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.166 1.911 . . . . 0.0 112.743 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -63.16 -39.19 93.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . 1.657 ' HE1' ' CE2' ' A' ' 8' ' ' PHE . 90.0 t80 -75.25 -42.0 56.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.812 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.68 96.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.35 77.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.012 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.3 ttp -68.59 -32.65 72.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.55 -36.92 79.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.828 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . 1.661 ' HE2' ' CE1' ' A' ' 13' ' ' TYR . 86.8 t80 -65.35 -42.85 92.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.807 -179.932 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -62.21 -48.73 78.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -65.34 -30.38 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.994 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -70.98 -33.72 70.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -79.28 -37.1 38.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -67.37 -36.78 82.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.753 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.17 -36.93 75.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.958 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.559 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.12 -52.24 56.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.992 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -48.88 69.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.548 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 25' ' ' VAL . 12.4 pt-20 -65.29 -30.74 71.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.774 0.321 . . . . 0.0 111.085 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.419 ' O ' HD11 ' A' ' 27' ' ' LEU . 85.6 m-20 -65.45 -47.9 74.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.033 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.559 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 6.2 mt -58.36 -52.47 65.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.034 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.458 HG21 ' N ' ' A' ' 26' ' ' VAL . 34.1 m -52.62 -45.63 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.458 ' N ' HG21 ' A' ' 25' ' ' VAL . 40.8 t -73.92 -44.75 50.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.878 0.37 . . . . 0.0 110.889 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.488 HD22 ' O ' ' A' ' 75' ' ' ALA . 0.9 OUTLIER -61.24 -21.6 64.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.337 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -70.03 -32.69 70.97 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.659 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -71.83 -33.41 68.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.52 -0.763 . . . . 0.0 109.431 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.42 -41.3 76.55 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . 0.414 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.5 t -66.14 -38.73 88.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.141 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.659 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -66.65 -40.03 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.463 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.73 -42.46 97.36 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.306 178.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.418 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.54 -49.12 76.5 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.611 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.05 -22.24 66.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.984 -0.608 . . . . 0.0 110.023 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.518 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 m-70 -74.47 -33.14 62.8 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.571 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.16 -34.31 61.44 Favored Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 179.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.611 HG23 ' HA ' ' A' ' 35' ' ' ALA . 18.2 tt -78.05 -35.94 20.97 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.206 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.565 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.664 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.51 -38.61 59.33 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.664 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.45 -39.15 81.57 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.803 0.335 . . . . 0.0 111.2 -178.848 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.447 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 10.7 m-85 -77.37 -32.82 55.19 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.606 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.596 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -57.77 -46.75 84.12 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.413 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.96 -54.18 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.028 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -76.13 -54.35 6.96 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 -177.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 0.504 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.37 -38.24 60.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 113.959 -1.473 . . . . 0.0 114.501 -175.449 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.527 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.34 16.35 0.08 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.12 0.418 . . . . 0.0 111.904 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.516 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.97 156.73 0.71 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . 0.448 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.53 7.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.9 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . 0.516 ' H ' ' C ' ' A' ' 47' ' ' ALA . 25.1 m95 -90.65 -24.43 20.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.679 0.276 . . . . 0.0 110.854 178.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -27.67 67.15 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.177 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 48' ' ' ALA . 44.4 pt -68.19 -28.9 42.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.741 0.305 . . . . 0.0 110.809 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -54.37 -34.98 62.29 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.677 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.85 30.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.408 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -127.11 98.85 5.46 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.752 0.787 . . . . 0.0 110.442 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.2 mm? -75.01 -18.89 60.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.778 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.582 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.25 -53.82 0.17 Allowed Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.582 ' HD3' ' HB1' ' A' ' 56' ' ' ALA . 87.0 Cg_exo -48.35 -44.88 28.24 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.639 1.559 . . . . 0.0 112.109 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.59 -47.61 44.82 Favored Glycine 0 CA--C 1.505 -0.555 0 CA-C-N 115.798 -0.637 . . . . 0.0 113.408 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.42 83.98 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.94 -0.63 . . . . 0.0 111.53 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.447 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -65.01 -32.73 74.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.162 0.506 . . . . 0.0 110.054 178.944 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.636 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 3.6 m-85 -76.15 -46.49 28.38 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.195 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.57 85.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.584 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.644 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.5 t80 -71.26 -55.65 7.65 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.76 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -78.15 -23.56 47.69 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.674 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.82 -30.21 48.77 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.605 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -91.27 -29.68 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.644 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.52 -50.82 56.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.929 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.76 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 39.0 Cg_endo -64.47 -39.77 27.13 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 123.02 2.48 . . . . 0.0 112.126 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tt -57.67 -54.8 42.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.426 ' O ' HD22 ' A' ' 74' ' ' LEU . 10.9 mp -57.69 -52.73 64.24 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.469 179.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.54 -50.86 52.24 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.537 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 49.9 tp -57.06 -44.73 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.614 0.245 . . . . 0.0 111.497 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 mt -71.29 -38.32 71.8 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.426 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.7 pp -82.5 -19.69 38.25 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 110.438 -179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.488 ' O ' HD22 ' A' ' 27' ' ' LEU . . . -94.86 -8.58 36.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.537 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.3 tp -78.55 145.29 67.13 Favored Pre-proline 0 C--O 1.231 0.111 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.55 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.456 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 Cg_exo -54.85 153.9 23.26 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 121.97 1.78 . . . . 0.0 111.24 178.958 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.47 -57.09 2.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.164 1.909 . . . . 0.0 113.368 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -62.56 -26.25 68.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.24 -46.81 31.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.837 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 1.644 ' HD1' ' CD2' ' A' ' 81' ' ' TYR . 0.5 OUTLIER -77.58 -24.88 49.63 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.777 -178.889 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.71 -44.89 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.545 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.24 -16.44 63.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.967 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.3 54.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.907 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -96.51 175.18 6.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.954 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.025 -179.933 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 111.008 -0.42 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . 0.461 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 39.7 tp -71.54 -18.77 62.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.871 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.3 -34.71 57.49 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.42 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' SER . . . . . 0.599 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 41.6 t -56.03 -50.85 84.98 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.599 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 32.3 Cg_exo -58.57 -29.16 88.19 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.015 1.81 . . . . 0.0 112.534 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.22 -58.09 6.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.172 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -60.89 -43.73 98.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.94 -42.55 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.975 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.37 96.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.99 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.7 mtp -63.77 -31.64 72.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.774 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.45 -39.7 92.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -64.23 -48.2 76.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.292 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -58.8 -49.27 78.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.14 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -60.91 -33.84 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.17 -35.95 76.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -73.73 -34.83 64.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.984 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.54 -43.14 70.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.894 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -64.35 -32.06 73.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.163 0.506 . . . . 0.0 110.287 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.558 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -66.78 -53.32 34.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.874 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -47.37 72.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.793 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLU . . . . . 0.43 ' O ' HG23 ' A' ' 25' ' ' VAL . 12.2 pt-20 -64.45 -31.37 72.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.923 0.392 . . . . 0.0 111.027 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ASN . . . . . 0.483 ' O ' HD12 ' A' ' 27' ' ' LEU . 6.4 m-20 -66.75 -53.14 36.33 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.771 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.558 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt -50.06 -52.16 36.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . 0.43 HG23 ' O ' ' A' ' 22' ' ' GLU . 29.6 m -55.29 -40.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 27' ' ' LEU . 25.4 m -80.11 -40.66 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.353 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.662 HD11 HG21 ' A' ' 26' ' ' VAL . 11.0 mp -61.89 -27.14 68.59 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.15 -39.09 82.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.375 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.645 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -69.08 -33.82 74.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.247 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.493 ' HB3' HD11 ' A' ' 71' ' ' LEU . . . -69.45 -43.85 72.44 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.2 t -65.28 -36.93 85.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.429 179.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.645 HG11 ' O ' ' A' ' 29' ' ' ALA . 0.7 OUTLIER -67.87 -43.3 86.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.987 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.481 ' N ' HG11 ' A' ' 32' ' ' VAL . . . -60.73 -43.42 97.91 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.915 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.428 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.04 -49.8 71.65 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.447 -0.882 . . . . 0.0 111.206 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . 0.53 ' HA ' HG23 ' A' ' 38' ' ' ILE . . . -65.51 -21.26 66.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.085 -0.557 . . . . 0.0 110.215 178.294 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.508 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 m-70 -75.73 -32.7 60.14 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.562 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.65 59.84 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.959 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.603 ' O ' HD21 ' A' ' 42' ' ' LEU . 11.6 tt -77.75 -36.86 23.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.52 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LEU . . . . . 0.651 HD13 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.68 -37.19 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.651 ' N ' HD13 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -70.32 -38.57 74.96 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 120.865 0.364 . . . . 0.0 111.061 -178.92 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.49 ' CD2' ' HB3' ' A' ' 60' ' ' ALA . 11.7 m-85 -77.42 -33.56 54.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.54 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.603 HD21 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -57.17 -47.2 81.79 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.308 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.5 t -70.01 -54.2 20.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.138 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' PHE . . . . . 1.648 ' HD1' ' CD2' ' A' ' 44' ' ' PHE . 22.2 m-85 -76.42 -54.37 6.83 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -177.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PHE . . . . . 1.62 ' HE2' ' CE1' ' A' ' 45' ' ' PHE . 0.0 OUTLIER -73.92 -45.71 48.86 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.484 -175.232 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . 0.513 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 31.6 t -59.27 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.463 -178.842 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.49 -142.39 0.44 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.11 9.08 9.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.948 0.404 . . . . 0.0 110.625 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -90.52 -25.19 20.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' TYR . . . . . 0.468 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.1 p90 -66.08 -26.69 67.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.216 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.43 -28.6 41.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.841 0.353 . . . . 0.0 110.671 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -54.46 -52.34 62.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.143 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.6 42.22 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.31 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.468 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 9.8 ptp180 -147.75 96.28 2.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.635 0.731 . . . . 0.0 111.546 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.424 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -71.41 -18.02 62.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.793 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.532 ' HB1' ' HD3' ' A' ' 57' ' ' PRO . . . -25.36 -52.41 0.17 Allowed Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . 0.593 ' HB3' ' HH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -47.63 -45.18 24.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 121.284 1.323 . . . . 0.0 111.944 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -48.89 44.24 Favored Glycine 0 CA--C 1.505 -0.551 0 CA-C-N 115.941 -0.572 . . . . 0.0 113.523 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.68 88.23 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.938 -0.631 . . . . 0.0 111.373 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ALA . . . . . 0.49 ' HB3' ' CD2' ' A' ' 41' ' ' PHE . . . -64.2 -33.97 77.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.212 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . 1.633 ' HD1' ' CD2' ' A' ' 61' ' ' TYR . 3.7 m-85 -74.53 -43.21 56.9 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.812 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.2 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.023 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . 0.652 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.0 m-85 -71.13 -54.77 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.761 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -77.85 -23.6 48.86 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.58 -29.49 48.33 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 119.888 -1.148 . . . . 0.0 111.617 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.01 -28.5 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.7 -50.44 73.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 114.944 -1.026 . . . . 0.0 111.048 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PRO . . . . . 0.761 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.6 Cg_endo -65.18 -38.93 25.34 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.082 2.522 . . . . 0.0 112.171 -178.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.467 HD11 HD21 ' A' ' 73' ' ' LEU . 1.7 tm? -57.55 -56.49 21.18 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LEU . . . . . 0.44 ' O ' HD22 ' A' ' 74' ' ' LEU . 11.1 mp -56.64 -50.73 71.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.085 179.327 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 30' ' ' ALA . 63.6 mt -49.82 -53.43 25.48 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.546 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.7 tt -57.21 -42.99 82.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.542 0.21 . . . . 0.0 111.482 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.467 HD21 HD11 ' A' ' 69' ' ' LEU . 4.6 mm? -72.02 -38.2 69.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.809 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.44 HD22 ' O ' ' A' ' 70' ' ' LEU . 1.0 OUTLIER -82.65 -20.74 35.68 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.406 179.756 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ALA . . . . . 0.536 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -93.25 -4.74 51.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 109.464 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.546 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.3 tp -78.88 144.14 63.46 Favored Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.103 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.5 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 62.6 Cg_exo -50.89 152.2 10.29 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 121.883 1.722 . . . . 0.0 111.118 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_exo -50.23 -60.3 0.88 Allowed 'Trans proline' 0 CA--C 1.528 0.197 0 C-N-CA 122.185 1.923 . . . . 0.0 113.528 -178.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -63.12 -25.23 68.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.259 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.59 -44.37 34.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.864 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' TYR . . . . . 0.413 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.6 OUTLIER -78.72 -25.22 44.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.518 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.59 71.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.162 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.6 -20.71 64.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.815 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -75.04 -20.74 59.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.994 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -81.22 121.79 26.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.962 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.338 -0.839 . . . . 0.0 111.027 -179.851 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 C--O 1.231 0.166 0 CA-C-O 120.752 0.23 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.95 -38.28 90.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.682 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.96 -31.73 68.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.567 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.24 -40.97 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.217 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.22 83.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.263 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -68.25 -38.66 82.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -60.76 -41.76 96.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.034 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -63.34 -30.54 71.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.802 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -70.24 -47.94 59.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.55 -31.26 72.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -72.09 -32.48 67.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -75.85 -40.93 53.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -68.19 -41.95 80.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.876 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.643 ' HE3' HD22 ' A' ' 23' ' ' ASN . 6.8 tmtm? -63.51 -37.0 85.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.637 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.77 -53.0 46.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.155 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.498 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.38 -46.6 73.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.877 -179.084 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.498 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.3 pt-20 -65.68 -32.47 74.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.741 0.305 . . . . 0.0 111.399 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.661 ' O ' HD13 ' A' ' 27' ' ' LEU . 6.9 m-20 -67.07 -54.49 20.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.746 0.308 . . . . 0.0 111.256 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.7 mt -50.72 -52.02 44.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' GLU . 32.7 m -54.84 -42.75 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.6 t -77.01 -51.64 18.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.61 0.243 . . . . 0.0 111.48 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -53.51 -35.13 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -62.38 -38.01 87.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.307 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.686 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -67.34 -32.57 73.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.763 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.466 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.68 -41.27 75.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.304 0.573 . . . . 0.0 109.508 177.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.1 t -67.39 -36.91 82.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.359 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -68.25 -43.63 84.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.96 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.429 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -61.32 -42.87 99.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.91 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.413 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -63.15 -49.67 69.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.117 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.565 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.53 -20.66 66.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.102 178.16 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.8 m-70 -75.79 -31.9 59.66 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.58 -33.47 58.24 Favored Glycine 0 N--CA 1.435 -1.393 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.097 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.9 tt -78.25 -35.99 20.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.45 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.18 -36.49 58.66 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -70.97 -38.26 72.76 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 120.798 0.332 . . . . 0.0 111.015 -178.892 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.69 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.48 -33.5 54.51 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.471 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.694 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -57.93 -46.47 84.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.971 0.891 . . . . 0.0 108.698 176.238 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 39' ' ' LEU . 89.0 t -70.42 -53.26 23.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.093 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -76.21 -54.39 6.87 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.82 -45.7 34.49 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 113.886 -1.507 . . . . 0.0 114.556 -175.266 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 16.1 t -54.9 -80.85 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.054 0.388 . . . . 0.0 111.356 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 51.16 -147.98 0.38 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.447 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.3 7.87 9.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.928 0.394 . . . . 0.0 110.865 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -90.97 -25.39 19.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.191 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.27 -26.29 64.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.563 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 48' ' ' ALA . 38.9 pt -68.9 -29.48 43.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.823 0.344 . . . . 0.0 111.055 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -55.08 -39.16 68.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.839 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 162.33 34.06 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.881 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.2 ttm180 -129.12 95.98 4.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.876 0.846 . . . . 0.0 110.569 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 58' ' ' GLY . 44.8 mt -75.64 -20.11 58.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.726 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.48 -54.82 0.2 Allowed Pre-proline 0 N--CA 1.47 0.542 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.5 Cg_exo -48.74 -42.9 35.95 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.696 1.597 . . . . 0.0 112.056 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.76 -49.24 41.77 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.42 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.52 -38.91 91.81 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.896 -0.652 . . . . 0.0 111.262 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.69 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.91 -35.56 80.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.343 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.694 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.7 m-85 -73.57 -43.13 60.58 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.826 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.9 -39.31 83.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.013 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -70.76 -54.85 10.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -78.12 -23.28 47.9 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.22 -29.87 48.47 Favored Glycine 0 CA--C 1.518 0.263 0 C-N-CA 119.736 -1.221 . . . . 0.0 111.521 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.27 -27.21 4.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.667 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.17 -49.95 78.43 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.913 178.534 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.8 Cg_endo -65.78 -38.05 25.35 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.161 2.574 . . . . 0.0 112.071 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.74 -55.13 39.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -56.24 -51.12 69.28 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.783 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.466 HD13 ' HB1' ' A' ' 30' ' ' ALA . 77.5 mt -51.21 -49.41 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.387 0.429 . . . . 0.0 111.667 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.655 HD12 HD23 ' A' ' 27' ' ' LEU . 31.0 tp -57.12 -45.76 83.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.712 0.291 . . . . 0.0 111.229 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.25 -38.61 71.91 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -81.59 -23.62 36.97 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.733 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.632 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -91.42 -0.38 57.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.41 0.624 . . . . 0.0 109.377 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 18.9 tp . . . . . 0 CA--C 1.531 0.244 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.366 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 C--O 1.231 0.162 0 N-CA-C 112.658 0.214 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.43 -49.61 70.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -67.23 -42.45 83.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.218 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.21 -36.75 80.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.13 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.7 -37.09 67.94 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.3 tpp -65.91 -34.88 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -66.0 -35.79 81.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -64.64 -41.99 95.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.695 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -64.95 -48.73 73.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.108 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -63.49 -33.29 75.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.422 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.07 -33.91 65.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.066 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -73.79 -40.76 63.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.965 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.98 -35.32 76.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.948 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -66.0 -40.71 91.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.76 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.586 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.31 -48.12 74.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.62 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -49.52 69.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.44 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.64 -31.46 71.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.366 . . . . 0.0 110.723 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.626 ' O ' HD13 ' A' ' 27' ' ' LEU . 26.8 t-20 -61.42 -53.86 51.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.968 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.8 mt -55.55 -39.88 71.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.799 0.333 . . . . 0.0 110.672 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.74 -46.12 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.909 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.4 t -73.6 -41.05 55.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.538 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.1 mp -58.6 -27.6 64.81 Favored 'General case' 0 CA--C 1.522 -0.102 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -69.81 -32.57 71.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.218 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.32 -36.05 63.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.884 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.49 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.09 -40.41 78.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.3 t -67.66 -39.42 84.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.276 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.6 -41.59 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.08 97.3 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.457 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.31 -49.97 69.29 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.183 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.603 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.96 -20.18 65.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.32 -0.44 . . . . 0.0 110.262 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.8 m-70 -75.77 -31.68 59.61 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.639 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.61 -31.5 56.28 Favored Glycine 0 N--CA 1.433 -1.564 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.511 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.688 ' O ' HD13 ' A' ' 42' ' ' LEU . 13.9 tt -78.43 -35.11 18.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.215 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.807 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.94 -35.79 50.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.896 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.807 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.8 p -71.52 -37.96 71.14 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.072 0.463 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.647 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.6 m-85 -75.56 -35.9 60.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.483 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.2 mp -56.89 -43.71 81.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 39' ' ' LEU . 82.2 t -70.86 -47.79 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.751 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.47 -53.7 8.23 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -178.103 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.72 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 17.0 m-85 -80.98 -48.15 12.66 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.588 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.0 t -62.19 1.99 0.27 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.703 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.536 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -44.54 153.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.413 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.94 5.69 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.536 ' H ' ' C ' ' A' ' 47' ' ' ALA . 38.8 m95 -90.2 -23.49 21.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.603 0.24 . . . . 0.0 111.076 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.478 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.03 -14.09 62.83 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.865 0.364 . . . . 0.0 110.755 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 48' ' ' ALA . 14.6 pt -68.55 -26.9 34.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.511 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -52.35 -39.77 61.12 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.357 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.08 39.14 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.986 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.567 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.5 ptt180 -135.11 102.34 5.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.751 0.786 . . . . 0.0 111.619 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.533 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -73.17 -17.5 61.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.522 178.589 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.05 -51.86 0.15 Allowed Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.72 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.1 Cg_exo -47.82 -48.5 15.85 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.418 1.412 . . . . 0.0 112.019 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.57 -48.26 28.73 Favored Glycine 0 CA--C 1.508 -0.37 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.066 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.94 93.81 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.357 -0.421 . . . . 0.0 111.969 -178.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.647 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.47 -31.5 72.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.313 0.578 . . . . 0.0 110.175 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.656 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -78.05 -45.13 24.42 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.207 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -35.87 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.239 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.4 t80 -71.33 -55.29 8.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.328 -179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.807 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -78.33 -23.19 47.12 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.483 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -79.31 -29.39 49.99 Favored Glycine 0 CA--C 1.517 0.194 0 C-N-CA 119.994 -1.098 . . . . 0.0 111.29 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.82 -28.46 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.29 -49.91 73.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.669 178.72 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.4 Cg_endo -62.75 -39.51 42.27 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.887 2.391 . . . . 0.0 111.611 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 73' ' ' LEU . 10.1 tt -57.36 -59.41 5.18 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.0 mp -51.02 -50.82 57.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.729 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 ' HB1' ' A' ' 30' ' ' ALA . 98.2 mt -52.62 -45.6 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.275 0.36 . . . . 0.0 111.75 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.19 -44.74 95.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.341 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.4 mp -71.54 -38.58 71.04 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -80.57 -28.04 37.31 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.553 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.87 -0.04 55.78 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 39.6 tp . . . . . 0 C--O 1.231 0.117 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.91 179.362 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.472 0.209 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.25 -45.28 93.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.497 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -69.3 -37.23 77.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.185 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.92 -33.52 73.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.294 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.77 -41.48 62.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.76 -32.0 73.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.796 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.95 -37.27 83.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.745 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -64.22 -45.26 89.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.001 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -61.85 -51.09 69.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -60.45 -39.97 89.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.267 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.33 -34.74 78.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.096 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -74.3 -37.27 63.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -70.55 -32.88 70.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.981 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -72.23 -38.33 68.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.826 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.94 -50.36 56.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.96 -48.68 72.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.271 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.451 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.8 pt-20 -63.96 -33.98 76.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.622 0.248 . . . . 0.0 110.794 -179.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.564 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.1 m-20 -58.83 -52.55 65.26 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 2.4 mt -48.17 -50.4 29.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.524 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.1 t -49.75 -53.92 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.276 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.56 -45.66 77.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 73.3 mt -61.52 -24.34 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.705 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -67.27 -30.4 70.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.84 -31.28 66.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.007 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.98 76.71 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.459 ' HB2' HD21 ' A' ' 72' ' ' LEU . 33.7 t -65.32 -43.27 91.54 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.997 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -62.28 -40.43 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.51 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.18 99.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.608 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.75 -49.54 75.12 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.612 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.81 -19.94 65.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.146 -0.527 . . . . 0.0 110.352 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.463 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.7 m-70 -76.17 -31.57 58.58 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.26 -32.0 56.37 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.531 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 35' ' ' ALA . 12.9 tt -77.67 -36.2 22.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.285 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.811 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.08 -36.29 55.92 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.811 ' N ' HD12 ' A' ' 39' ' ' LEU . 48.6 p -71.15 -36.37 72.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 110.649 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 17.0 m-85 -78.23 -35.98 47.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -55.74 -46.11 77.86 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.92 0.867 . . . . 0.0 108.709 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.8 t -70.33 -49.36 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.123 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.4 m-85 -75.98 -54.0 7.53 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.697 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 6.8 m-85 -77.18 -48.68 16.97 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 40.4 t -53.1 -81.28 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.568 -175.459 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 41.51 -141.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.458 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 13.11 9.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.885 0.374 . . . . 0.0 110.729 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 20.1 m95 -91.18 -26.27 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.264 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.501 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -69.02 -31.55 70.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.332 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.8 pt -61.34 -28.15 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.873 0.368 . . . . 0.0 110.436 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -54.06 -50.89 65.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.077 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.25 40.62 0.04 OUTLIER Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.035 -1.079 . . . . 0.0 113.877 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.563 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 8.0 ptm180 -148.39 105.46 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.741 0.782 . . . . 0.0 111.83 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.432 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.3 pp -74.46 -17.8 60.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.597 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.81 -51.98 0.15 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.697 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 90.7 Cg_exo -47.86 -49.17 14.26 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.331 1.354 . . . . 0.0 111.878 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -49.15 -49.68 29.98 Favored Glycine 0 CA--C 1.505 -0.564 0 CA-C-N 115.995 -0.548 . . . . 0.0 113.616 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.67 -42.42 99.61 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.017 -0.592 . . . . 0.0 111.619 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.43 -36.97 76.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.296 0.57 . . . . 0.0 110.217 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.633 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.2 m-30 -72.07 -46.49 56.67 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.025 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.8 88.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.704 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.612 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.4 m-85 -71.51 -54.18 11.41 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.82 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.66 -24.59 49.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.78 -31.54 43.97 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.54 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.26 -25.79 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.632 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.05 -51.69 59.64 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.639 178.331 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.82 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.72 -39.4 26.76 Favored 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 122.95 2.434 . . . . 0.0 112.257 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tt -58.26 -54.42 47.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.844 0.354 . . . . 0.0 110.415 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 74' ' ' LEU . 6.4 tp -58.01 -53.8 54.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.37 -52.57 27.46 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 27' ' ' LEU . 2.7 mm? -57.55 -45.08 85.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 85.5 mt -69.62 -38.45 77.23 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.538 HD23 ' HG ' ' A' ' 70' ' ' LEU . 1.7 pp -82.27 -19.97 38.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.028 0.442 . . . . 0.0 110.201 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.95 -7.17 43.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.761 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 17.2 tp . . . . . 0 CA--C 1.532 0.26 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.129 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 C--O 1.232 0.201 0 N-CA-C 112.682 0.224 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.59 -56.12 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.468 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -68.18 -31.38 70.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.525 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -44.27 83.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.52 -27.6 63.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.055 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.9 ttt -73.7 -38.19 64.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.12 -33.32 75.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.836 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -69.17 -37.62 78.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -69.35 -42.07 75.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.795 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -66.26 -43.86 85.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.947 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.68 -38.37 90.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.945 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -70.73 -36.65 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.828 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -70.72 -34.22 71.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.056 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -71.1 -39.44 72.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.25 -47.8 75.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -56.14 -49.64 73.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.634 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.47 -33.25 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.76 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.464 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.7 m120 -60.7 -41.09 94.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.434 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.6 mt -59.51 -48.34 82.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 110.786 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.452 HG23 ' H ' ' A' ' 25' ' ' VAL . 3.4 t -49.87 -53.58 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.371 -178.681 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.612 HG23 HD13 ' A' ' 27' ' ' LEU . 4.8 m -71.49 -39.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.424 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.612 HD13 HG23 ' A' ' 26' ' ' VAL . 1.5 mp -63.66 -24.24 67.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.285 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -69.53 -32.11 70.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.722 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.53 -33.9 67.19 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.725 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.47 -43.79 72.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.281 0.562 . . . . 0.0 109.623 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.423 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -64.18 -38.67 91.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.203 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.722 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.6 OUTLIER -66.26 -40.56 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.448 179.023 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.28 93.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.514 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.14 77.18 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 178.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.567 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.08 -20.47 66.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.085 -0.558 . . . . 0.0 110.109 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.471 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.3 m-70 -75.99 -32.32 59.4 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.07 -34.08 58.85 Favored Glycine 0 N--CA 1.433 -1.542 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.888 178.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 35' ' ' ALA . 17.5 tt -77.27 -37.22 25.28 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.359 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.25 -38.23 60.62 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.54 -38.57 77.53 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.252 -178.69 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.0 m-85 -77.68 -33.49 53.25 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.577 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.28 -47.07 82.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.919 0.866 . . . . 0.0 108.838 176.468 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.83 -54.41 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.169 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -76.36 -54.42 6.78 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.541 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.32 -46.0 52.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 113.877 -1.51 . . . . 0.0 114.395 -175.347 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.533 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -60.02 -81.42 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.445 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.76 -141.08 0.36 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -119.08 9.97 11.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 -90.26 -27.94 19.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.2 p90 -66.85 -40.21 87.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.824 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -28.73 45.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -54.82 -52.05 63.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.825 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.02 44.77 0.06 OUTLIER Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.375 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 17.2 ptp180 -157.68 102.44 1.87 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.696 0.76 . . . . 0.0 111.653 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 pp -73.9 -18.38 60.91 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.167 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.17 -52.99 0.17 Allowed Pre-proline 0 N--CA 1.47 0.534 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.1 Cg_exo -48.37 -42.9 33.68 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 121.486 1.457 . . . . 0.0 112.16 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -46.91 48.77 Favored Glycine 0 CA--C 1.505 -0.535 0 CA-C-N 115.905 -0.588 . . . . 0.0 113.105 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.06 89.7 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.804 -0.698 . . . . 0.0 111.447 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.62 -32.06 73.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.02 0.438 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.572 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -76.37 -49.35 17.05 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.333 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.25 93.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.836 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.5 t80 -71.15 -54.71 10.1 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.81 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.57 -23.94 49.89 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.789 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.52 -29.47 48.71 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.672 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 p -91.28 -29.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.76 -50.43 73.58 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.187 179.123 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.81 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.37 -40.46 24.75 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 C-N-CA 122.962 2.442 . . . . 0.0 112.075 -178.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.93 -54.75 43.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.382 . . . . 0.0 110.01 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.7 mt -57.97 -53.34 59.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.411 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 86.7 mt -49.58 -52.87 27.16 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.433 0.458 . . . . 0.0 112.11 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 58.8 tp -56.81 -46.21 81.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.634 0.254 . . . . 0.0 111.614 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.6 -37.96 77.11 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.62 -21.72 35.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.002 0.429 . . . . 0.0 110.243 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.529 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -91.25 -10.41 41.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.581 178.394 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 24.8 tp . . . . . 0 CA--C 1.533 0.304 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo . . . . . 0 C--O 1.23 0.109 0 CA-C-O 120.915 0.298 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.06 -43.45 98.87 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.047 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -69.22 -47.75 63.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.78 -37.07 78.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.277 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.44 -32.55 64.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.453 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 44.2 ttp -69.54 -45.48 68.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.016 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.12 -31.44 71.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.755 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -66.61 -40.71 88.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.737 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LYS . . . . . 0.408 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 24.6 ttmm -64.26 -48.0 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.706 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.35 -24.26 66.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.17 -53.18 13.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.093 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 14' ' ' LYS . 3.0 p30 -67.63 -30.81 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.978 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -68.83 -45.64 70.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.014 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -64.9 -36.56 84.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -63.72 -51.3 65.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.9 -49.51 71.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.638 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.409 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.4 pt-20 -63.68 -35.07 79.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.724 0.297 . . . . 0.0 111.141 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.479 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.9 m120 -59.82 -43.76 94.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.687 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.9 mt -58.08 -48.58 79.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.03 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.4 t -49.68 -53.69 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.193 -178.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.569 HG23 HD13 ' A' ' 27' ' ' LEU . 4.3 m -72.07 -38.64 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.59 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.569 HD13 HG23 ' A' ' 26' ' ' VAL . 1.9 mp -63.96 -24.85 67.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.272 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -70.01 -30.0 67.2 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.96 -34.77 66.71 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.419 178.464 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.12 78.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.1 t -66.71 -38.63 87.13 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -66.52 -41.66 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.86 94.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.487 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.6 -49.54 75.66 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.607 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.36 -22.16 66.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.067 -0.567 . . . . 0.0 110.238 178.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.2 m-70 -75.6 -31.76 60.05 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.569 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.25 -33.9 58.56 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.946 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 35' ' ' ALA . 20.0 tt -77.89 -36.57 22.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.512 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.7 -37.06 59.79 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.71 -38.82 77.09 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.623 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -77.6 -32.5 53.64 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.619 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.592 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.76 -46.75 84.1 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.12 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 91.9 t -69.9 -54.16 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 114.949 -1.023 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -76.23 -54.93 6.08 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -38.15 64.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 113.679 -1.601 . . . . 0.0 114.447 -175.301 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.489 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 7.4 t -70.57 16.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.849 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.526 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -50.18 156.59 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.85 8.79 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.526 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.83 -25.84 19.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.659 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.22 63.53 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.616 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 48' ' ' ALA . 30.7 pt -70.03 -29.26 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.287 . . . . 0.0 111.022 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -54.71 -29.91 54.57 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 149.52 30.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 113.138 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.0 ttm180 -122.52 98.77 6.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.825 0.821 . . . . 0.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.13 -18.87 60.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.404 179.219 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.9 -54.49 0.19 Allowed Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 79.8 Cg_exo -49.09 -45.09 30.74 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.492 1.462 . . . . 0.0 112.027 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.53 -47.26 45.17 Favored Glycine 0 CA--C 1.506 -0.524 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.345 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.57 94.87 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.945 -0.627 . . . . 0.0 111.496 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.623 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.96 -35.13 79.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 0.0 110.238 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.592 ' CE1' HD12 ' A' ' 42' ' ' LEU . 3.1 m-30 -73.15 -43.81 60.99 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.863 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.7 -39.44 84.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.007 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.3 m-85 -71.01 -54.64 10.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.828 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.1 m-85 -77.76 -24.06 49.1 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.36 45.7 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.056 -1.069 . . . . 0.0 111.721 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -91.13 -27.51 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.109 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.43 -50.57 75.76 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.114 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.828 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.6 Cg_endo -64.96 -40.51 20.49 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.112 2.541 . . . . 0.0 112.155 -178.096 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -55.79 30.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.107 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.03 -52.61 64.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.223 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 71.7 mt -49.63 -53.64 22.98 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.362 0.414 . . . . 0.0 112.073 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.452 HD12 HD23 ' A' ' 27' ' ' LEU . 40.2 tp -57.59 -44.7 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.45 -39.67 81.38 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.3 pp -82.65 -20.15 36.86 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.214 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.496 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.15 -9.51 42.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.523 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.5 tp . . . . . 0 CA--C 1.532 0.271 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.114 179.478 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.666 0.194 . . . . 0.0 112.568 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.31 -38.82 84.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.81 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -71.54 -35.47 70.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.85 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.91 -34.91 74.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.089 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.55 -48.85 45.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.427 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 91.6 mtp -59.89 -43.62 94.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.99 -37.22 76.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.02 -51.2 70.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -60.2 -36.71 78.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -66.34 -37.73 86.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.688 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.55 -45.13 76.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.9 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -67.93 -31.95 72.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' HD23 ' A' ' 21' ' ' LEU . 15.6 t70 -67.96 -49.54 61.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.815 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -62.57 -28.59 69.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.719 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.16 66.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.472 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.72 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.1 pp -62.4 -44.13 97.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.68 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 11.9 pt-20 -68.44 -37.58 80.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.795 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.61 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.7 m-20 -66.15 -55.02 18.42 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.973 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.7 tp -52.23 -52.0 55.0 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 21' ' ' LEU . 18.8 m -52.34 -44.49 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.442 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.0 t -75.46 -41.18 42.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.796 0.332 . . . . 0.0 110.993 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 87.2 mt -63.7 -22.43 66.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.412 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -69.65 -30.39 68.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.736 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.44 -33.63 65.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.442 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.03 76.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.6 t -65.53 -41.08 93.47 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.06 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.736 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.65 -38.89 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.75 97.9 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.277 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.47 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.11 -49.65 72.93 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.47 -21.21 66.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.926 -0.637 . . . . 0.0 110.254 178.359 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.464 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.4 m-70 -75.59 -31.75 60.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.28 -32.95 57.51 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.861 178.633 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.591 ' O ' HD13 ' A' ' 42' ' ' LEU . 14.0 tt -77.92 -36.08 21.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.335 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.85 -35.97 57.12 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.989 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.808 ' N ' HD12 ' A' ' 39' ' ' LEU . 32.8 p -70.83 -38.14 73.23 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.071 0.462 . . . . 0.0 110.537 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.628 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 16.4 m-85 -76.01 -35.24 59.62 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.389 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.591 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.5 mp -56.21 -45.49 79.84 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.941 0.877 . . . . 0.0 108.763 176.603 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.4 t -70.98 -48.22 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.097 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.77 -53.84 7.87 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -177.804 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.681 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.4 m-85 -78.82 -48.71 14.24 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.485 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 29.4 t -52.5 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.029 -0.669 . . . . 0.0 111.913 -175.384 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 44.73 -143.16 0.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.41 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.74 12.18 9.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.976 0.417 . . . . 0.0 110.846 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.9 m95 -91.13 -28.64 17.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.208 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.519 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.26 -28.22 66.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.527 -179.18 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.9 pt -65.06 -28.9 45.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.329 . . . . 0.0 111.067 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -54.56 -32.01 57.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.034 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 150.57 44.88 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.608 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -141.78 100.96 3.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.644 0.735 . . . . 0.0 110.664 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.85 -20.03 58.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.249 178.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.66 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.96 -54.03 0.19 Allowed Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.681 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.6 Cg_exo -50.14 -47.89 22.08 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.694 1.596 . . . . 0.0 111.94 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.58 -48.03 29.02 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.747 -0.661 . . . . 0.0 113.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.91 -42.86 97.31 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.134 -0.533 . . . . 0.0 111.794 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.628 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.72 -34.7 73.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.304 0.573 . . . . 0.0 110.153 179.146 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.634 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -74.1 -46.24 44.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.969 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.98 92.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.632 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.34 -54.77 9.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.836 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.67 -24.31 49.39 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.7 -32.15 42.28 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.493 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.21 -26.11 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.12 -51.0 72.15 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.942 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.836 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.0 Cg_endo -64.44 -40.14 25.67 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 122.841 2.36 . . . . 0.0 112.132 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -57.92 -56.22 24.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.955 0.407 . . . . 0.0 110.342 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.0 mt -57.44 -54.15 50.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.426 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.4 mt -48.88 -50.95 32.46 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.395 0.434 . . . . 0.0 112.011 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.489 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 2.4 tt -59.21 -50.57 73.51 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.655 -179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.57 -37.71 88.51 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 2.0 pp -81.6 -24.34 36.5 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.377 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.51 -7.63 52.46 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.369 0.604 . . . . 0.0 109.525 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.4 tm? . . . . . 0 CA--C 1.532 0.275 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.496 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--O 1.23 0.123 0 N-CA-C 112.751 0.251 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.29 -46.6 82.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.706 0.288 . . . . 0.0 111.155 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -67.34 -36.99 82.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.08 -42.58 84.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.61 -43.41 98.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.989 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.0 ttt -62.87 -34.28 77.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.636 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.06 -42.56 99.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.984 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -63.63 -33.76 76.33 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -69.8 -52.64 23.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -61.09 -32.26 71.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.151 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.93 -31.53 68.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.857 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -77.41 -43.66 31.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.061 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.98 -34.43 78.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.283 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -68.23 -48.91 63.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.226 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.18 78.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.338 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.479 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.01 -46.46 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.546 -179.74 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.479 ' N ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -66.75 -37.11 83.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.677 0.275 . . . . 0.0 111.099 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 95.2 m-20 -63.13 -38.76 92.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.0 110.613 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.51 -53.65 55.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.454 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' LEU . 23.1 t -51.44 -48.22 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.494 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.567 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -73.32 -36.2 48.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.656 0.265 . . . . 0.0 111.074 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.567 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -65.92 -24.01 66.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.034 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.38 -30.6 68.63 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.731 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.32 -33.69 65.28 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.463 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.47 74.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.452 0.644 . . . . 0.0 109.346 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.1 m -65.23 -40.61 94.3 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.318 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.731 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -63.08 -39.62 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.5 -41.45 97.3 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.381 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.17 -49.74 71.9 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.625 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.75 -20.18 65.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.157 -0.522 . . . . 0.0 110.176 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.5 m-70 -75.72 -33.21 60.29 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.33 -32.91 59.48 Favored Glycine 0 N--CA 1.43 -1.748 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.43 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.642 ' O ' HD13 ' A' ' 42' ' ' LEU . 12.4 tt -77.46 -36.63 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.527 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.865 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.93 -38.85 57.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.865 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -71.19 -36.17 71.83 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.981 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 13.1 m-85 -76.1 -35.93 59.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.121 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.642 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.8 mp -56.05 -44.83 79.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.1 t -70.91 -48.28 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.941 -1.027 . . . . 0.0 112.048 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -53.77 8.12 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.87 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.742 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.8 m-85 -79.23 -47.72 15.46 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -176.543 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.545 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.2 t -60.78 -0.53 0.29 Allowed 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.549 -175.509 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.521 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -46.9 161.18 0.07 Allowed 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -62.77 10.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.521 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.29 -26.3 20.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.778 0.323 . . . . 0.0 110.532 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -69.48 -33.1 72.38 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.219 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.6 pt -59.56 -27.7 38.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.899 0.38 . . . . 0.0 110.687 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -53.27 -42.39 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.087 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.89 48.62 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.053 -1.07 . . . . 0.0 113.52 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 13.4 ptp180 -154.88 107.13 2.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.741 0.782 . . . . 0.0 111.708 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.459 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 4.4 pp -74.12 -16.84 61.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.618 178.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -23.99 -51.52 0.12 Allowed Pre-proline 0 N--CA 1.467 0.384 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.742 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 82.3 Cg_exo -47.39 -49.96 12.14 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 121.379 1.386 . . . . 0.0 111.823 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -48.39 -48.07 27.84 Favored Glycine 0 CA--C 1.509 -0.307 0 CA-C-N 115.879 -0.6 . . . . 0.0 113.905 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.27 97.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.141 -0.529 . . . . 0.0 112.049 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.189 0.519 . . . . 0.0 110.126 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.648 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -75.45 -45.03 41.13 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.179 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.05 83.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.693 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 23.5 t80 -71.19 -54.54 10.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.29 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.62 -23.77 49.73 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.833 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.02 -29.19 47.39 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.614 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -90.94 -29.08 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.693 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.81 -50.44 73.83 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.978 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.6 Cg_endo -63.84 -39.57 32.89 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.933 2.422 . . . . 0.0 111.902 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.1 -58.24 9.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.918 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 mp -56.62 -51.51 68.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.32 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.2 mt -49.33 -52.64 26.64 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 47.6 tp -59.31 -44.25 92.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.4 tp -70.34 -39.08 74.9 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.91 -25.79 34.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.005 0.431 . . . . 0.0 110.411 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.531 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -85.79 -8.55 58.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 33.8 tp . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.777 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.708 0.212 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -58.1 -50.35 73.78 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -64.19 -36.47 84.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -32.7 73.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.57 -36.79 60.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.082 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 85.9 mtp -70.54 -35.66 73.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.23 -35.71 81.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.789 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -67.03 -36.34 81.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.387 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -66.46 -50.23 64.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.607 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.96 -41.33 91.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.865 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -62.53 -32.62 73.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.588 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.26 -41.71 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.675 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -66.43 -31.39 72.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -72.53 -35.68 68.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.724 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.19 -48.22 68.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.433 ' O ' HG22 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -57.68 -49.5 76.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.5 -35.7 81.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.666 0.269 . . . . 0.0 111.567 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.481 ' O ' HD13 ' A' ' 27' ' ' LEU . 92.1 m-20 -65.87 -42.51 90.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.787 0.327 . . . . 0.0 111.012 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.08 -55.74 30.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 21' ' ' LEU . 2.3 m -52.81 -43.91 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.295 -178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -72.1 -41.59 67.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.807 0.337 . . . . 0.0 110.946 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.515 ' HB3' HD23 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -64.67 -22.93 67.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.508 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -69.31 -34.25 74.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.713 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.16 65.71 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.723 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -44.69 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.286 0.565 . . . . 0.0 109.601 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 43.2 t -64.37 -39.6 94.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.212 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -64.5 -40.76 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.246 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.31 95.64 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.338 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.44 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.93 -49.36 76.39 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.609 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.01 -21.35 66.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.254 178.441 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 10.1 m-70 -75.96 -33.28 59.79 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.589 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.82 -33.42 60.17 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.924 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.609 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.9 tt -77.78 -36.77 22.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.479 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.886 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.49 -37.95 59.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.886 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.19 -38.47 78.65 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 120.75 0.309 . . . . 0.0 111.016 -178.778 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.559 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.0 m-85 -77.9 -32.78 51.94 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.459 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.523 HD12 ' CE1' ' A' ' 61' ' ' TYR . 0.9 OUTLIER -57.68 -46.99 83.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 122.024 0.916 . . . . 0.0 108.674 176.399 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 39' ' ' LEU . 90.6 t -70.15 -53.92 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.007 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -76.07 -54.28 7.08 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.31 -45.82 45.0 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.039 -1.437 . . . . 0.0 114.387 -175.331 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.547 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -61.09 -81.15 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.317 -179.008 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.97 -144.83 0.35 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.11 13.49 10.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.12 -35.3 14.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.011 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -63.2 -13.69 40.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.344 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.9 pt -67.05 -28.55 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.055 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -53.82 -29.6 41.46 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.684 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.11 30.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.749 . . . . 0.0 113.069 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.7 ttm180 -117.83 99.17 6.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.674 0.75 . . . . 0.0 110.253 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.518 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -74.71 -19.89 60.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.59 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.604 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.22 -54.21 0.19 Allowed Pre-proline 0 N--CA 1.467 0.418 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.0 Cg_exo -48.4 -45.83 25.33 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.589 1.526 . . . . 0.0 112.032 178.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.26 -47.03 43.48 Favored Glycine 0 CA--C 1.506 -0.496 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.411 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.29 95.93 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.9 -0.65 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.559 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.14 -33.38 74.37 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.108 0.48 . . . . 0.0 110.228 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.593 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-85 -75.26 -44.2 47.18 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.833 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.2 87.58 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.779 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.53 -54.65 9.85 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -77.68 -24.13 49.38 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.47 45.25 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.045 -1.074 . . . . 0.0 111.574 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.25 -26.74 5.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.35 -50.49 75.88 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.829 178.657 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.7 Cg_endo -64.06 -39.64 30.82 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 122.974 2.449 . . . . 0.0 111.973 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.29 -56.27 23.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.048 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -57.32 -52.81 63.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.418 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.2 mt -49.28 -52.9 24.62 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 3.2 tm? -56.59 -45.17 81.55 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.6 mt -71.14 -39.09 72.19 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.69 -21.02 38.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.969 0.414 . . . . 0.0 110.5 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.498 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -93.65 -8.99 39.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.88 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 5.1 tp . . . . . 0 C--N 1.332 -0.153 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.404 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.664 0.193 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.34 -53.17 61.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -66.31 -38.79 88.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.354 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.69 84.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.56 -36.93 68.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.979 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 tpp -65.81 -41.61 91.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.43 -37.73 81.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.728 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -62.31 -43.45 98.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.673 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -62.9 -55.33 26.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.015 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -57.45 -32.51 67.0 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.377 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.06 -44.07 77.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -69.45 -33.1 72.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.75 -37.27 73.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.165 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -70.95 -34.79 71.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -68.72 -52.83 26.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.442 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.23 -45.19 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.496 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.442 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.7 pt-20 -66.95 -30.98 71.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.864 0.364 . . . . 0.0 110.736 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.48 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.3 m-20 -68.0 -42.33 80.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.232 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.9 mt -62.78 -51.51 66.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.737 0.303 . . . . 0.0 111.715 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.6 m -53.2 -45.43 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.535 HG13 HD13 ' A' ' 27' ' ' LEU . 8.3 p -74.91 -37.51 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.778 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.563 HD11 ' HB1' ' A' ' 75' ' ' ALA . 1.2 mp -64.32 -22.92 67.12 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.857 -0.424 . . . . 0.0 109.857 179.163 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -70.39 -31.2 68.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.294 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.726 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.14 -35.31 66.47 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.46 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.83 -38.89 80.16 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 32.9 t -66.81 -40.47 88.07 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.075 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.49 -39.24 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.021 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.4 98.94 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.387 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.425 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.84 -49.3 77.25 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.619 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -65.91 -21.59 66.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.071 -0.565 . . . . 0.0 110.284 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.45 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 8.1 m-70 -73.89 -31.9 63.33 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.54 -32.5 57.53 Favored Glycine 0 N--CA 1.434 -1.437 0 CA-C-N 114.086 -1.415 . . . . 0.0 111.006 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.6 tt -78.13 -35.97 20.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.279 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.814 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.11 -35.43 56.38 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.814 ' N ' HD12 ' A' ' 39' ' ' LEU . 34.0 p -70.22 -38.59 75.28 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.023 0.44 . . . . 0.0 110.969 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.658 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.9 m-85 -78.45 -34.0 48.05 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.849 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -57.04 -47.14 81.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.009 0.909 . . . . 0.0 108.711 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.8 t -70.26 -54.39 18.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.291 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -76.4 -54.56 6.56 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.497 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.44 -37.49 65.83 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 113.956 -1.474 . . . . 0.0 114.422 -175.303 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.488 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.56 16.18 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.089 0.404 . . . . 0.0 111.79 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -48.69 153.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.485 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -60.17 5.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.487 ' H ' ' C ' ' A' ' 47' ' ' ALA . 55.3 m95 -90.06 -24.83 21.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -22.05 63.89 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.161 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -69.09 -29.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.217 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -54.86 -42.88 72.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.628 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 164.76 30.65 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.066 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -120.98 97.01 5.33 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.855 0.836 . . . . 0.0 110.449 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 39.4 mt -75.14 -18.91 60.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.182 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.89 -53.72 0.19 Allowed Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 81.0 Cg_exo -49.52 -45.18 32.09 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.537 1.492 . . . . 0.0 112.056 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.38 -49.78 37.42 Favored Glycine 0 CA--C 1.505 -0.59 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.474 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.12 88.81 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.871 -0.665 . . . . 0.0 111.219 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.78 -36.84 84.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.241 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.581 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.5 m-85 -72.14 -43.87 63.99 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.765 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.3 87.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.893 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.643 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -71.46 -55.01 8.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.815 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -77.81 -24.16 48.85 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.736 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.44 -31.25 46.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 119.984 -1.103 . . . . 0.0 111.68 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -91.67 -26.47 5.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.64 -50.57 71.99 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.862 178.588 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.815 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 41.6 Cg_endo -64.79 -39.83 24.43 Favored 'Trans proline' 0 N--CA 1.448 -1.167 0 C-N-CA 122.978 2.452 . . . . 0.0 112.262 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.55 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.983 0.42 . . . . 0.0 110.339 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.2 mt -58.53 -53.83 53.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.096 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.9 mt -49.58 -51.67 35.52 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.347 0.404 . . . . 0.0 112.089 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.543 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.1 tt -58.2 -43.9 87.82 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 78.5 mt -70.99 -39.12 72.64 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -81.74 -23.2 36.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 110.353 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.563 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -89.83 -7.14 55.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.474 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tp . . . . . 0 N--CA 1.456 -0.168 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.225 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo . . . . . 0 C--O 1.231 0.136 0 CA-C-O 120.854 0.272 . . . . 0.0 112.296 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.02 -47.52 68.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.95 -42.43 94.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.91 -30.98 72.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.966 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.8 -44.14 64.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.021 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.0 mtt -65.8 -33.91 76.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.738 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.62 -42.3 95.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.579 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -58.66 -44.54 90.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.379 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.7 -37.38 86.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.235 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -66.44 -30.29 70.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.603 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -74.25 -32.28 62.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.665 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -76.24 -39.59 54.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -70.22 -31.91 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.08 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -71.49 -37.95 71.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.855 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.49 -40.72 85.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -49.2 74.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.806 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.0 pt-20 -64.44 -39.73 94.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.748 0.308 . . . . 0.0 111.729 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.553 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 12.5 m120 -63.2 -53.66 49.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.949 0.404 . . . . 0.0 110.695 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.3 mt -49.05 -56.06 10.18 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.45 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.5 m -53.09 -45.96 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' N ' HG23 ' A' ' 25' ' ' VAL . 27.8 m -74.4 -35.98 40.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.146 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 91.2 mt -66.99 -23.08 65.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.049 0.452 . . . . 0.0 109.906 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -69.25 -31.02 69.28 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.06 -31.6 64.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.214 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.59 74.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.411 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 59.4 m -65.22 -42.18 93.71 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.241 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.4 p -62.46 -39.65 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.6 -43.69 97.12 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.393 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.448 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.27 -49.57 76.29 Favored Glycine 0 C--N 1.332 0.331 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.576 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.05 -21.68 66.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.047 -0.576 . . . . 0.0 110.279 178.383 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -74.59 -32.67 62.44 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.572 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.89 59.63 Favored Glycine 0 N--CA 1.433 -1.511 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.747 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.3 tt -77.45 -36.35 23.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.492 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.906 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.72 -38.75 58.29 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.906 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.9 -38.35 79.55 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -178.793 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.656 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.3 m-85 -77.84 -34.69 51.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.516 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -56.67 -47.23 80.26 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.933 0.873 . . . . 0.0 108.843 176.413 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 88.3 t -70.16 -54.21 19.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.816 -1.083 . . . . 0.0 112.266 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -76.88 -54.38 6.67 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.959 1.837 . . . . 0.0 115.959 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.02 -45.63 56.62 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 113.951 -1.477 . . . . 0.0 114.48 -175.44 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.473 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 24.9 t -55.95 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.477 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 49.73 -147.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.512 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.46 12.62 10.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.824 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -91.05 -29.6 17.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.892 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.01 -22.31 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.518 -179.098 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.7 pt -66.81 -29.7 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -54.83 -35.93 64.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.38 31.72 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.078 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.2 ttm180 -122.87 98.85 6.09 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.714 0.769 . . . . 0.0 110.208 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 58' ' ' GLY . 72.9 mt -75.19 -20.0 59.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.724 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.628 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.44 -54.49 0.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.412 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.628 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 75.4 Cg_exo -52.02 -45.44 38.83 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.562 1.508 . . . . 0.0 111.972 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -48.02 46.03 Favored Glycine 0 CA--C 1.504 -0.595 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.4 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -36.94 85.76 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.967 -0.617 . . . . 0.0 111.444 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.66 -35.07 79.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.177 0.513 . . . . 0.0 109.968 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.558 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.76 -48.98 33.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.086 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.914 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.3 t80 -71.27 -55.42 8.09 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.89 -23.96 48.57 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.692 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.09 -30.56 46.18 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.174 -1.012 . . . . 0.0 111.658 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.44 HG22 HD23 ' A' ' 70' ' ' LEU . 1.7 p -90.26 -29.94 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.394 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.684 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.93 -52.44 46.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.153 179.058 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.1 Cg_endo -64.61 -40.06 24.82 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 123.053 2.502 . . . . 0.0 112.441 -178.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -56.71 18.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.533 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 66' ' ' VAL . 4.5 mm? -58.61 -53.27 60.2 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.622 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.4 mt -49.48 -51.8 33.59 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 65.2 tp -58.28 -45.58 87.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.87 -38.05 76.29 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.48 -20.0 37.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.093 0.473 . . . . 0.0 110.426 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.37 -7.24 42.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.767 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 15.8 tp . . . . . 0 CA--C 1.532 0.28 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.131 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo . . . . . 0 C--O 1.231 0.137 0 CA-C-O 120.707 0.211 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.72 -53.52 46.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -64.08 -41.69 97.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.996 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.14 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.32 68.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.384 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.0 mtp -68.33 -30.13 69.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.35 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.09 -46.75 70.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.338 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.34 -37.61 83.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.883 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -68.51 -44.69 74.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.57 -43.47 98.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.757 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.64 -28.67 69.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.452 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -74.93 -41.73 59.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.641 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -67.83 -34.61 77.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.72 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.16 -33.58 74.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -69.11 -54.26 15.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.025 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.32 -40.89 68.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.681 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.457 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.2 pt-20 -71.77 -32.49 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.779 0.323 . . . . 0.0 111.163 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 84.2 m-20 -66.96 -54.49 21.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.945 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.0 mt -53.46 -51.28 63.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.7 m -52.77 -46.11 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.73 -37.15 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.849 0.357 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 97.0 mt -66.96 -22.67 65.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.017 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.54 -29.86 68.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.743 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.56 -33.16 64.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.366 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -42.79 75.1 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.5 t -65.49 -40.61 93.26 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.088 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.25 -40.67 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.57 96.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.271 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.85 -49.6 74.23 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.48 -19.63 65.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.045 -0.577 . . . . 0.0 110.509 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -77.74 -31.65 52.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.3 -32.14 58.43 Favored Glycine 0 N--CA 1.432 -1.573 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.41 178.417 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.9 tt -78.05 -36.09 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.393 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.799 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.37 -35.92 54.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.799 ' N ' HD12 ' A' ' 39' ' ' LEU . 56.4 p -71.38 -35.17 70.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.189 0.519 . . . . 0.0 110.5 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 18.1 m-30 -79.49 -35.36 40.31 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.279 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -55.86 -46.72 78.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.765 0.793 . . . . 0.0 108.924 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' N ' ' A' ' 44' ' ' PHE . 35.0 m -72.42 -46.16 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.243 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.8 m-85 -76.59 -53.91 7.4 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.716 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 9.3 m-85 -77.84 -48.7 15.86 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.493 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -54.44 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.233 -174.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.79 -145.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 8.31 9.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.941 0.401 . . . . 0.0 110.496 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.9 m95 -91.28 -26.76 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.596 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -63.8 -34.12 77.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.568 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.4 pt -56.49 -26.97 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -52.48 -48.73 65.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.235 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 173.15 49.76 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.073 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.566 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.8 ptt180 -156.21 102.02 2.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.535 0.683 . . . . 0.0 111.856 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' A' ' 56' ' ' ALA . 38.7 mt -73.91 -18.23 60.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.207 178.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.23 -53.79 0.17 Allowed Pre-proline 0 N--CA 1.463 0.224 0 O-C-N 123.691 0.619 . . . . 0.0 112.388 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.716 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 83.7 Cg_exo -47.61 -51.12 10.22 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.271 1.314 . . . . 0.0 111.87 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.62 -50.0 26.08 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 115.858 -0.61 . . . . 0.0 113.694 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.83 96.37 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.191 -0.504 . . . . 0.0 111.847 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -60.42 -34.08 73.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -75.03 -51.62 13.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.523 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.32 79.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.589 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.705 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.3 t80 -71.29 -55.28 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.533 -178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.71 -23.82 49.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.27 -29.78 44.0 Favored Glycine 0 N--CA 1.454 -0.142 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.616 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.29 -30.29 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.216 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.69 -51.29 61.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.314 179.208 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 48.2 Cg_endo -64.94 -39.75 23.57 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 122.814 2.343 . . . . 0.0 111.992 -178.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 tm? -57.56 -57.51 12.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.123 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 4.4 mm? -57.09 -52.03 66.92 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.432 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.03 -50.96 45.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.425 HD13 ' C ' ' A' ' 72' ' ' LEU . 3.2 tm? -58.28 -45.57 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.533 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 69' ' ' LEU . 10.8 mp -71.34 -37.88 71.68 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -81.48 -23.58 37.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.01 0.433 . . . . 0.0 110.263 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.0 -6.04 56.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.336 0.589 . . . . 0.0 109.613 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.8 tp . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.003 179.338 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo . . . . . 0 CA--C 1.526 0.113 0 CA-C-O 120.74 0.225 . . . . 0.0 112.609 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.42 -43.27 86.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.017 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -70.93 -40.31 72.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.992 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.8 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.368 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.78 -34.76 69.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.173 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.3 tpp -67.62 -41.24 84.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.42 -32.09 73.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.133 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -66.55 -48.1 70.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.909 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.71 -44.13 96.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.797 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.06 -32.83 74.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . 0.444 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.5 t70 -68.24 -37.64 81.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.459 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.86 -31.06 59.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.97 -43.85 70.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' NZ ' ' HA ' ' A' ' 16' ' ' ASP . 9.2 ptpp? -65.55 -32.91 74.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.748 0.309 . . . . 0.0 111.021 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.38 -51.26 54.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.68 -47.1 77.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.902 -179.733 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.6 pt-20 -66.55 -37.16 84.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.749 0.309 . . . . 0.0 111.671 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 5.8 m-20 -65.22 -43.52 91.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.237 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.56 -54.89 39.95 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -52.39 -45.41 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.537 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -74.51 -38.18 45.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 120.679 0.276 . . . . 0.0 110.806 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.537 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -63.66 -24.54 67.83 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.35 -32.57 73.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.725 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.59 -32.12 67.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.354 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -45.12 69.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.46 0.648 . . . . 0.0 109.367 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.452 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 58.1 m -64.43 -39.44 93.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.31 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.725 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.89 -41.68 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.052 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.59 -43.48 93.67 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.437 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -61.49 -49.53 76.1 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.94 -21.84 66.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.429 178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.488 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.4 m-70 -76.29 -31.97 58.52 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.65 -32.58 59.23 Favored Glycine 0 N--CA 1.434 -1.461 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.898 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' HA ' ' A' ' 35' ' ' ALA . 15.1 tt -78.44 -36.51 20.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.363 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.03 -35.73 59.39 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.816 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.1 p -69.78 -40.49 76.01 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.963 0.411 . . . . 0.0 110.881 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -76.53 -33.45 58.58 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.803 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.58 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.5 -46.89 83.23 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.943 0.878 . . . . 0.0 108.852 176.305 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.9 t -70.27 -54.35 19.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.112 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -76.25 -54.45 6.78 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.859 1.799 . . . . 0.0 115.859 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -45.56 49.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.833 -1.53 . . . . 0.0 114.458 -175.361 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.63 -81.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.402 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 46.8 -147.33 0.17 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -117.64 10.63 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.963 0.411 . . . . 0.0 110.263 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -91.05 -24.99 19.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.306 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -68.97 -32.96 72.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.291 -179.128 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 pt -63.29 -28.03 44.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 110.618 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -53.84 -52.15 61.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.025 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.76 44.28 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.112 -1.042 . . . . 0.0 113.275 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.487 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 7.4 ptp180 -151.67 99.1 2.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.719 0.771 . . . . 0.0 111.45 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -72.48 -18.01 61.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.212 179.37 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.37 -52.77 0.17 Allowed Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -178.47 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.574 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 83.1 Cg_exo -48.76 -44.56 31.05 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.372 1.381 . . . . 0.0 112.173 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -47.75 47.35 Favored Glycine 0 CA--C 1.504 -0.597 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.274 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.31 90.6 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.846 -0.677 . . . . 0.0 111.308 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.79 -34.16 76.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.275 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.58 ' CE1' HD12 ' A' ' 42' ' ' LEU . 2.5 m-85 -75.31 -44.35 45.94 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.007 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.66 -39.19 88.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.628 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.3 -54.7 9.94 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.71 -23.94 49.34 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.726 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.36 42.74 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 119.957 -1.116 . . . . 0.0 111.648 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.87 -26.11 5.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.653 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.55 -51.32 70.64 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.663 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 37.9 Cg_endo -63.19 -41.31 28.23 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 123.209 2.606 . . . . 0.0 112.256 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.464 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.4 tm? -56.68 -56.8 16.79 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.32 -52.41 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.699 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.9 mt -49.65 -52.99 26.94 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.548 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 31.4 tp -56.77 -45.34 82.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.1 mp -71.01 -38.6 72.64 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.46 -22.88 37.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.039 0.447 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.499 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.18 -8.02 46.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.997 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.548 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.4 tp . . . . . 0 C--O 1.231 0.11 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.47 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.993 0.33 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.52 -33.74 76.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.452 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -75.6 -35.98 60.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.602 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -30.54 63.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.69 -46.22 47.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.8 ptm -63.84 -31.8 73.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.82 -36.08 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -67.0 -34.31 77.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.576 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -70.09 -46.54 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -66.24 -33.96 76.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.947 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.49 -48.48 64.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.0 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.61 -35.2 80.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -69.72 -39.38 76.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.258 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -68.37 -37.01 80.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.081 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.53 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.71 -53.14 45.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.078 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -48.57 70.39 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.692 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.6 pt-20 -63.92 -31.26 72.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.944 0.402 . . . . 0.0 110.996 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.448 ' O ' HD13 ' A' ' 27' ' ' LEU . 89.2 m-20 -67.64 -42.6 82.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.14 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -61.63 -50.91 70.65 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.0 m -54.75 -41.74 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.917 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.79 -41.8 47.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.746 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.511 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.6 OUTLIER -64.63 -20.6 66.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.372 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -70.89 -37.03 72.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.728 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.16 -32.4 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.801 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -45.6 68.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.232 0.539 . . . . 0.0 109.581 177.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.445 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 96.1 p -64.14 -38.2 90.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.2 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.728 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.61 -41.36 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.7 -42.81 93.84 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.425 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 64' ' ' TYR . . . -61.94 -49.38 76.13 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 178.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.605 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.03 -20.7 66.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.063 -0.569 . . . . 0.0 110.281 178.256 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.6 m-70 -75.76 -31.75 59.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.12 -32.61 58.24 Favored Glycine 0 N--CA 1.434 -1.494 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.62 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.7 tt -77.86 -36.72 22.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.318 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.83 -37.78 58.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.15 -38.28 78.7 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.922 0.391 . . . . 0.0 111.187 -178.896 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.681 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.4 m-85 -77.9 -33.61 51.84 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.418 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.1 mp -57.27 -47.37 81.62 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.8 t -70.16 -54.06 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.234 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -76.23 -54.12 7.25 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.496 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.84 -40.22 61.16 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 113.98 -1.464 . . . . 0.0 114.817 -175.197 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.429 ' SG ' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -67.95 9.28 0.31 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.282 0.492 . . . . 0.0 112.192 -178.549 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.504 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -43.92 153.52 0.13 Allowed 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 178.851 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.34 6.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 47' ' ' ALA . 26.4 m95 -90.78 -23.11 20.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.723 0.297 . . . . 0.0 110.899 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.416 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.04 -22.41 64.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.176 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.5 pt -70.1 -29.41 39.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 0.0 110.99 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -54.74 -33.68 61.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.874 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.58 29.39 0.03 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.519 -0.848 . . . . 0.0 113.307 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.418 ' O ' ' CG ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -124.28 97.65 5.42 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.711 0.767 . . . . 0.0 110.583 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 58' ' ' GLY . 36.1 mt -74.56 -19.23 60.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.135 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.57 -53.63 0.18 Allowed Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -178.343 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.8 Cg_exo -48.77 -46.43 24.53 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.417 1.411 . . . . 0.0 111.987 178.706 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.35 -48.0 42.03 Favored Glycine 0 CA--C 1.506 -0.508 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.528 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.22 93.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.923 -0.638 . . . . 0.0 111.31 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.681 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.49 -34.91 77.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.131 0.491 . . . . 0.0 109.976 179.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.583 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.0 m-85 -73.89 -42.84 60.11 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.767 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.95 85.52 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.796 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.49 -55.1 8.54 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.817 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.6 m-85 -77.86 -24.22 48.63 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.98 -31.01 44.78 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.948 -1.12 . . . . 0.0 111.609 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.02 -27.88 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.115 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -49.39 -51.16 60.38 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.974 178.477 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.817 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.9 Cg_endo -64.4 -40.43 24.66 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 123.053 2.502 . . . . 0.0 112.232 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -57.6 -55.52 33.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.58 -53.6 54.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.161 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -49.68 -52.53 30.35 Favored 'General case' 0 C--O 1.223 -0.31 0 O-C-N 123.403 0.439 . . . . 0.0 112.091 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 62.6 tp -57.39 -44.53 84.57 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.0 mp -71.42 -39.74 70.89 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.33 -23.97 37.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.379 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.511 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -90.48 -7.36 53.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.722 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.557 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.8 tp . . . . . 0 C--O 1.231 0.117 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.355 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.815 0.256 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.56 -34.61 78.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.765 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -75.94 -40.44 54.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.12 83.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.13 64.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 47.3 ttm -72.13 -43.48 64.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.981 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -63.87 -37.87 88.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -59.94 -50.86 72.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.746 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -59.46 -38.18 80.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.699 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -66.32 -39.79 89.51 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.058 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -66.06 -41.96 90.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -70.67 -32.78 70.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.73 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.526 ' HA ' HD23 ' A' ' 21' ' ' LEU . 24.1 t70 -68.5 -40.29 80.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.431 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -68.48 -28.86 67.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.443 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -53.18 36.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.328 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 25' ' ' VAL . 1.5 pp -59.31 -42.56 91.65 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.198 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.638 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -67.36 -42.98 82.58 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.357 -176.29 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.572 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.4 m-20 -63.14 -54.9 30.56 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.383 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.8 tp -51.95 -52.18 52.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 21' ' ' LEU . 74.8 t -50.12 -49.85 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.1 t -72.57 -40.36 62.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.14 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 92.6 mt -63.68 -21.82 66.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.396 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.68 -31.08 67.85 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.89 -34.44 69.17 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.267 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.68 79.35 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -66.54 -39.89 88.81 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.157 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -65.57 -39.77 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.038 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.06 96.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.166 178.768 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.78 -49.24 78.09 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.64 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.3 -23.07 66.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.255 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.492 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.8 m-70 -75.27 -31.97 60.91 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.584 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.83 -33.57 60.02 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.999 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.64 HG22 ' HA ' ' A' ' 35' ' ' ALA . 16.8 tt -78.52 -36.55 20.23 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.452 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.83 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.09 -35.85 59.18 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.83 ' N ' HD12 ' A' ' 39' ' ' LEU . 35.5 p -69.54 -39.69 77.33 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.014 0.435 . . . . 0.0 110.957 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.93 -32.33 51.53 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.3 -47.11 82.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.063 0.935 . . . . 0.0 108.565 176.22 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 39' ' ' LEU . 99.4 t -70.05 -54.35 19.29 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.727 0 CA-C-N 114.691 -1.14 . . . . 0.0 112.074 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -77.2 -54.76 6.1 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.499 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -72.1 -38.29 69.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.839 -1.528 . . . . 0.0 114.374 -175.317 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.481 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.9 t -69.54 15.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.025 0.375 . . . . 0.0 111.886 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.508 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.85 156.13 0.77 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.62 7.43 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.508 ' H ' ' C ' ' A' ' 47' ' ' ALA . 29.4 m95 -90.55 -23.99 20.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.899 0.381 . . . . 0.0 110.742 178.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -68.11 -25.14 65.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.392 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 48' ' ' ALA . 39.7 pt -71.33 -29.43 35.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.662 0.267 . . . . 0.0 111.246 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -55.86 -35.75 66.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.818 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.58 32.28 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.101 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -128.43 98.08 4.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.724 0.773 . . . . 0.0 110.653 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 3.8 pp -75.28 -19.14 59.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.937 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.35 -54.29 0.17 Allowed Pre-proline 0 N--CA 1.467 0.381 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.6 Cg_exo -48.43 -45.23 27.5 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.321 1.347 . . . . 0.0 111.749 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.93 -48.49 45.21 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 115.752 -0.658 . . . . 0.0 113.276 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.13 -36.14 83.06 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.587 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.11 -35.57 81.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.189 0.519 . . . . 0.0 110.071 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.59 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.9 m-85 -72.82 -49.0 33.05 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.997 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.22 90.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.692 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.1 t80 -70.97 -55.26 8.72 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.788 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.7 -24.19 49.28 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.11 -30.49 46.4 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.639 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.432 HG22 HD13 ' A' ' 70' ' ' LEU . 1.8 p -90.16 -29.65 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.137 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.692 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.28 -51.87 53.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.247 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.5 Cg_endo -64.89 -40.2 22.19 Favored 'Trans proline' 0 N--CA 1.448 -1.166 0 C-N-CA 123.015 2.476 . . . . 0.0 112.323 -178.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.08 -54.63 44.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 0.0 110.545 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 HG22 ' A' ' 66' ' ' VAL . 11.1 mp -57.37 -53.66 55.59 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.368 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.1 mt -50.64 -49.33 57.2 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.251 0.344 . . . . 0.0 111.8 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 45.9 tp -60.05 -43.21 95.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.7 mt -71.91 -38.55 69.89 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -82.16 -21.41 36.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.985 0.421 . . . . 0.0 110.311 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.13 -3.88 55.06 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.373 0.606 . . . . 0.0 109.779 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 1.5 tp . . . . . 0 CA--C 1.528 0.099 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.964 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 C--O 1.232 0.179 0 N-CA-C 112.686 0.226 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.03 -57.61 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.363 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -65.88 -31.41 72.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.276 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.94 -46.14 68.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.203 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.87 -37.15 86.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -67.16 -28.59 68.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.6 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -67.42 -40.2 85.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -65.04 -31.75 73.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -50.68 39.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.835 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.15 -28.94 69.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.02 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.56 -48.65 54.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.03 -34.51 76.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.097 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -67.79 -46.56 71.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.168 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.38 -38.25 88.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.563 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -64.81 -50.67 65.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.154 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.0 -48.78 70.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.635 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.438 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.5 pt-20 -65.04 -31.23 72.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.49 ' O ' HD13 ' A' ' 27' ' ' LEU . 10.0 m120 -65.78 -46.38 78.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.339 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -60.94 -52.44 65.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.7 m -53.57 -42.6 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.254 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.28 -41.76 43.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.382 . . . . 0.0 110.915 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.7 OUTLIER -64.25 -21.93 66.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.4 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -70.07 -30.66 67.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.718 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.59 -34.4 62.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.66 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.19 -42.73 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.281 0.562 . . . . 0.0 109.525 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.0 t -65.39 -41.43 93.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -62.54 -41.09 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.086 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.97 -42.06 97.59 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.27 -50.17 67.53 Favored Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.606 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.23 -20.1 65.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.113 -0.543 . . . . 0.0 110.184 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.476 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.3 m-70 -76.48 -32.27 58.25 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.61 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.32 -33.09 59.3 Favored Glycine 0 N--CA 1.43 -1.7 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.429 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.606 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.2 tt -77.08 -37.2 25.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.468 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.845 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.82 -37.24 59.27 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.845 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -72.71 -33.43 66.44 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.919 0.39 . . . . 0.0 110.853 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 14.7 m-85 -79.7 -35.06 39.61 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.822 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.26 -45.83 79.89 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.747 0.784 . . . . 0.0 108.923 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.8 m -72.59 -45.47 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.168 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -76.15 -54.0 7.46 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.208 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.709 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 8.7 m-85 -78.68 -49.08 13.77 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.507 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -57.07 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.516 -0.874 . . . . 0.0 111.562 -175.41 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' CYS . . . 38.27 -139.51 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.88 18.75 10.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.956 0.408 . . . . 0.0 110.561 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -90.37 -37.15 14.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.824 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.442 ' CB ' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.17 -15.24 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.069 -179.484 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -58.62 -28.87 37.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.865 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -54.45 -29.96 51.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.821 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.73 26.08 0.3 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.479 -0.867 . . . . 0.0 113.357 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER -110.97 105.74 14.62 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.263 0.554 . . . . 0.0 110.244 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 56' ' ' ALA . 50.8 mt -74.31 -18.87 60.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.16 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.47 -52.17 0.17 Allowed Pre-proline 0 N--CA 1.468 0.428 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.709 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 88.1 Cg_exo -49.88 -49.67 15.39 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 121.728 1.618 . . . . 0.0 112.055 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.41 -49.36 26.25 Favored Glycine 0 CA--C 1.506 -0.503 0 CA-C-N 115.943 -0.572 . . . . 0.0 114.014 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.32 99.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.171 -0.515 . . . . 0.0 111.734 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.5 -34.84 73.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.24 0.543 . . . . 0.0 110.164 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.652 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -74.39 -44.36 52.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.169 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.17 86.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.673 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.1 m-85 -71.4 -54.77 9.61 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.827 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -77.73 -24.19 49.16 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.62 -31.42 45.21 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.605 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 p -91.8 -24.69 5.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.82 -50.53 77.28 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.714 178.297 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.827 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.0 Cg_endo -63.62 -39.75 33.62 Favored 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.923 2.415 . . . . 0.0 111.882 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 73' ' ' LEU . 10.0 tt -57.41 -58.15 9.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.185 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 10.8 mp -55.29 -52.84 62.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.451 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.7 mt -49.78 -52.54 31.18 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.327 0.392 . . . . 0.0 112.041 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 46.9 tp -56.83 -45.41 82.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.717 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.5 mm? -70.47 -38.98 74.51 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.02 -20.9 37.44 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.049 0.452 . . . . 0.0 110.452 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.572 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -93.55 -12.07 30.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.4 tp . . . . . 0 N--CA 1.456 -0.164 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.322 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.762 0.234 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.22 -44.4 95.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.82 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -67.6 -31.37 71.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.91 -38.41 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.156 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.41 -41.75 84.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.028 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 95.6 mmm -66.05 -34.28 77.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -62.67 -37.84 88.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -65.6 -36.04 82.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -69.71 -48.02 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.999 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -66.13 -32.22 73.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.968 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.71 -49.49 52.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.57 -34.11 77.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.69 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.554 ' HA ' HD23 ' A' ' 21' ' ' LEU . 21.9 t70 -64.45 -49.86 69.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.56 -28.61 69.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.783 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.11 -56.68 8.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.555 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.681 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.2 pp -54.93 -43.97 73.81 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.508 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.681 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 12.8 pt-20 -67.35 -34.01 76.44 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -177.188 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.622 ' O ' HD13 ' A' ' 27' ' ' LEU . 92.0 m-20 -67.71 -54.79 16.56 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.96 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.8 mt -53.52 -49.95 66.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 21' ' ' LEU . 19.6 m -53.68 -42.04 49.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -177.426 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 HD12 ' A' ' 27' ' ' LEU . 7.2 p -82.02 -39.13 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.425 0.155 . . . . 0.0 111.369 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.622 HD13 ' O ' ' A' ' 23' ' ' ASN . 10.4 mp -61.69 -27.86 69.0 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.77 -38.11 82.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.925 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -68.5 -31.91 71.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.739 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.69 -42.38 74.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.342 0.592 . . . . 0.0 109.7 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.432 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 34.0 t -67.42 -36.64 81.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.315 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -67.82 -44.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.075 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.434 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.86 -44.1 97.47 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.838 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.416 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.92 -49.62 73.79 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.314 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.589 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.72 -20.29 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.276 -0.462 . . . . 0.0 110.208 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.6 m-70 -76.12 -32.24 59.06 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.579 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -33.05 58.71 Favored Glycine 0 N--CA 1.435 -1.425 0 CA-C-N 114.265 -1.334 . . . . 0.0 110.854 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.5 tt -77.4 -37.44 25.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.383 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.58 -38.1 59.4 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.268 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.2 -37.78 78.29 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 120.804 0.335 . . . . 0.0 110.982 -178.812 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.639 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -78.21 -32.69 50.02 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.515 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -58.1 -46.79 84.93 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 176.262 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.4 t -69.93 -53.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.047 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -76.11 -54.91 6.13 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.521 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.78 -45.42 43.79 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.828 -1.533 . . . . 0.0 114.48 -175.236 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.511 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.46 -81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.122 0.419 . . . . 0.0 111.615 -178.638 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 50.35 -146.39 0.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.497 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.03 9.08 9.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.092 0.472 . . . . 0.0 110.616 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -91.13 -26.53 19.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.208 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.453 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.1 p90 -67.74 -23.39 65.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.455 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 48' ' ' ALA . 32.3 pt -70.66 -28.5 34.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.884 0.373 . . . . 0.0 110.702 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 52' ' ' LYS . 5.3 ttpm? -54.08 -29.55 44.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.913 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.26 37.53 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.594 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -133.96 97.79 3.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.817 0.818 . . . . 0.0 110.731 -179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.61 -19.78 58.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.452 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.626 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.31 -54.68 0.2 Allowed Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 71.0 Cg_exo -50.43 -43.38 44.72 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 121.645 1.563 . . . . 0.0 112.037 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.47 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.8 -46.3 48.6 Favored Glycine 0 CA--C 1.507 -0.467 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.364 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.23 86.11 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.519 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.88 -31.07 71.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.568 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.8 m-30 -77.15 -45.23 27.48 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.926 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.93 -38.95 87.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.716 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 18.6 t80 -71.18 -55.04 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.9 -23.34 48.72 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.54 -28.99 50.48 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 119.867 -1.159 . . . . 0.0 111.652 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -91.66 -30.12 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.32 -49.84 68.26 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.992 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.1 Cg_endo -64.83 -39.09 27.07 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.93 2.42 . . . . 0.0 112.01 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.14 -54.81 42.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.52 -50.8 70.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.767 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 30' ' ' ALA . 72.0 mt -51.0 -51.09 56.49 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.351 0.407 . . . . 0.0 111.977 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 8.8 tt -59.99 -40.4 89.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.684 0.278 . . . . 0.0 111.487 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.2 tp -73.62 -40.52 63.73 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 pp -80.14 -28.47 38.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.594 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.506 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.34 -3.1 58.93 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.263 0.554 . . . . 0.0 109.518 178.52 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.59 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.4 tp . . . . . 0 C--O 1.232 0.168 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.092 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo . . . . . 0 N--CA 1.472 0.247 0 N-CA-C 113.12 0.392 . . . . 0.0 113.12 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.19 -38.1 82.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.702 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -75.09 -39.26 60.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.767 0.317 . . . . 0.0 111.163 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.87 -41.38 95.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.4 -37.1 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.831 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.0 ttm -68.0 -34.18 76.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.94 -41.7 97.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.62 -36.34 78.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.315 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -69.41 -40.82 77.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.839 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -66.43 -46.64 75.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.192 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.14 -27.61 68.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.236 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.32 -43.2 33.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.941 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.47 -33.52 74.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -69.47 -38.29 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.26 -53.98 36.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.822 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -49.25 68.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.8 pt-20 -64.35 -31.53 72.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 0.0 111.057 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.586 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -66.43 -54.1 28.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.167 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 1.0 OUTLIER -53.58 -50.08 66.37 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.422 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.5 m -53.83 -44.98 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.28 -37.25 31.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.125 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 93.0 mt -66.83 -20.41 65.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.102 0.477 . . . . 0.0 109.889 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -70.79 -31.21 67.9 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.739 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.78 66.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.251 178.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.48 -41.53 76.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.8 t -66.25 -40.53 90.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.083 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -63.39 -38.79 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.39 96.85 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.31 178.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.475 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.73 71.57 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.607 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.96 -20.71 65.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.133 -0.533 . . . . 0.0 110.164 178.217 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.5 m-70 -74.94 -33.3 61.93 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.618 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.81 -33.3 60.32 Favored Glycine 0 N--CA 1.431 -1.673 0 CA-C-N 113.98 -1.464 . . . . 0.0 110.393 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.1 tt -78.05 -35.59 20.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.695 -179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.855 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.8 -37.57 55.54 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.855 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -73.06 -33.24 65.55 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.851 0.358 . . . . 0.0 111.024 -179.107 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.5 m-30 -79.48 -35.39 40.3 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.927 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -56.36 -46.18 80.12 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.79 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.04 -46.11 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.1 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.5 m-85 -76.52 -54.37 6.8 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.702 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 11.1 m-85 -77.31 -48.78 16.49 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -176.184 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.501 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 49.0 t -56.05 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.763 -175.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 42.63 -143.42 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.96 12.83 9.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.549 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.618 ' HB3' HH21 ' A' ' 54' ' ' ARG . 25.8 m95 -90.66 -32.44 16.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.584 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -63.96 -11.7 30.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.818 0.342 . . . . 0.0 111.313 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.6 pt -65.25 -27.59 42.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.658 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 53' ' ' GLY . 22.2 ptmt -52.67 -43.26 65.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.179 -178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.402 ' N ' ' HG3' ' A' ' 52' ' ' LYS . . . 157.43 38.74 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.254 -0.974 . . . . 0.0 112.997 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.618 HH21 ' HB3' ' A' ' 49' ' ' TRP . 16.0 ptt180 -132.29 102.4 5.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.508 0.671 . . . . 0.0 111.492 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 58' ' ' GLY . 35.0 mt -73.32 -17.48 61.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.048 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.606 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.98 -52.55 0.16 Allowed Pre-proline 0 N--CA 1.465 0.302 0 O-C-N 123.768 0.667 . . . . 0.0 112.52 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.702 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.8 Cg_exo -48.25 -51.16 10.59 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.35 1.367 . . . . 0.0 111.798 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.82 -49.17 29.1 Favored Glycine 0 CA--C 1.509 -0.34 0 CA-C-N 115.978 -0.556 . . . . 0.0 113.896 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.09 99.7 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.063 -0.568 . . . . 0.0 111.776 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.625 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.78 -35.22 74.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.279 0.562 . . . . 0.0 110.219 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.643 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.3 m-30 -73.45 -45.79 52.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.119 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.54 -38.32 89.29 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.8 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.675 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 10.5 m-85 -71.39 -54.49 10.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.69 -24.02 49.4 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.99 -31.67 42.52 Favored Glycine 0 CA--C 1.516 0.147 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.481 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -89.93 -27.44 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.139 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.675 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.28 -51.75 60.41 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.95 178.795 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.7 Cg_endo -62.37 -42.95 25.05 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 123.157 2.571 . . . . 0.0 112.143 -178.5 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.6 tm? -57.17 -55.31 36.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 88.2 mt -57.89 -55.3 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.399 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 72' ' ' LEU . 4.3 pp -55.16 -38.35 68.16 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.655 ' N ' HD12 ' A' ' 71' ' ' LEU . 47.6 tp -66.83 -44.42 81.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.688 0.28 . . . . 0.0 111.057 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.8 mp -70.97 -36.65 72.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -82.53 -23.82 34.37 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.113 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.42 -5.82 57.08 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp . . . . . 0 C--O 1.232 0.177 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.919 179.316 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo . . . . . 0 C--O 1.231 0.17 0 N-CA-C 112.805 0.271 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.1 -50.97 62.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.32 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -71.04 -31.16 67.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.67 -40.16 76.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.372 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.87 72.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.176 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.58 -40.32 88.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -62.16 -32.12 72.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.776 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -67.48 -39.95 85.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.568 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -67.34 -40.61 85.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.644 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.41 -40.79 89.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -64.12 -40.62 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.396 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.89 -34.58 75.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.443 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 21' ' ' LEU . 16.2 t70 -67.18 -40.92 86.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.558 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HB2' ' HZ2' ' A' ' 19' ' ' LYS . 10.5 mtmp? -66.74 -28.89 68.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.429 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.09 -56.62 9.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.187 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LEU . . . . . 0.674 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.7 pp -55.51 -39.89 71.07 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 120.835 0.35 . . . . 0.0 110.978 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.605 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -69.38 -40.89 77.15 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.453 -176.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.613 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 m-20 -65.7 -55.28 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.476 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 7.3 mt -52.41 -51.6 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 21' ' ' LEU . 26.7 m -52.53 -44.55 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.215 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.4 t -76.34 -40.97 35.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.687 0.279 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 86.0 mt -63.9 -21.35 66.42 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.021 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -69.5 -32.96 72.16 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.698 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.33 -31.8 65.98 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.41 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.78 -44.0 71.02 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 38.6 t -65.05 -40.12 94.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.247 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.698 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.05 -40.59 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.08 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.74 98.86 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.681 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.422 ' HA2' ' HD2' ' A' ' 64' ' ' TYR . . . -62.16 -49.6 73.34 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.601 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.4 -20.15 65.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.277 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.5 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 m-70 -76.57 -32.11 57.95 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -32.57 59.29 Favored Glycine 0 N--CA 1.434 -1.483 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.653 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.0 tt -77.68 -36.74 23.2 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.388 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.84 -37.62 58.84 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.88 -36.54 75.53 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 120.842 0.353 . . . . 0.0 111.061 -178.802 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.605 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.9 m-85 -79.53 -33.33 42.06 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.296 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 46' ' ' CYS . 1.1 mp -57.65 -47.34 82.53 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.759 0.79 . . . . 0.0 108.986 176.689 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 44' ' ' PHE . 30.1 m -72.49 -50.8 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.329 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' PHE . . . . . 0.469 ' N ' HG23 ' A' ' 43' ' ' VAL . 36.7 t80 -77.08 -54.25 6.77 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -177.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.02 -45.91 46.84 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 113.967 -1.469 . . . . 0.0 114.195 -175.666 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.8 t -60.04 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.197 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.72 -142.17 0.47 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.23 11.37 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.037 0.446 . . . . 0.0 110.564 178.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -90.92 -28.21 18.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.032 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 1.2 p90 -67.23 -24.64 65.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.4 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 20.2 pt -66.37 -27.45 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 0.0 110.61 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -53.52 -52.35 59.91 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.12 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 169.8 40.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.179 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.487 ' HG2' ' HA ' ' A' ' 50' ' ' TYR . 19.8 ptp180 -144.18 101.46 3.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.595 0.712 . . . . 0.0 111.425 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -73.25 -17.96 61.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.094 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.24 -54.05 0.17 Allowed Pre-proline 0 N--CA 1.468 0.433 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.1 Cg_exo -47.84 -46.41 21.61 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.321 1.348 . . . . 0.0 111.774 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.39 -46.67 44.81 Favored Glycine 0 CA--C 1.507 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.496 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.8 94.92 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.939 -0.631 . . . . 0.0 111.542 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.605 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -63.14 -34.82 78.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.962 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.592 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.85 -44.53 61.27 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.656 179.07 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.9 88.45 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.857 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 5.7 m-85 -71.22 -54.96 9.15 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -178.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.76 -24.23 49.03 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.654 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.09 43.63 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.017 -1.087 . . . . 0.0 111.64 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.58 -26.78 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.84 -52.38 57.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.007 178.775 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.9 Cg_endo -64.76 -40.66 21.26 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 123.02 2.48 . . . . 0.0 112.501 -177.877 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER -57.59 -55.65 32.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.199 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.6 -53.93 51.87 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.313 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.5 mt -49.99 -51.67 39.92 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.353 0.408 . . . . 0.0 111.839 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LEU . 65.1 tp -58.36 -46.83 85.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.32 -38.11 81.24 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.91 -21.91 37.1 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.126 0.489 . . . . 0.0 110.122 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.55 -5.76 51.01 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.596 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 72' ' ' LEU . 21.3 tp . . . . . 0 CA--C 1.53 0.185 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.186 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.472 0.236 0 N-CA-C 112.743 0.247 . . . . 0.0 112.743 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -63.16 -39.19 93.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -75.25 -42.0 56.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.68 96.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.35 77.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.012 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.3 ttp -68.59 -32.65 72.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.55 -36.92 79.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.828 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -65.35 -42.85 92.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -62.21 -48.73 78.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -65.34 -30.38 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.994 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -70.98 -33.72 70.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -79.28 -37.1 38.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -67.37 -36.78 82.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.753 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.17 -36.93 75.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.958 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.567 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.12 -52.24 56.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.992 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -48.88 69.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.548 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.4 pt-20 -65.29 -30.74 71.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.774 0.321 . . . . 0.0 111.085 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.431 ' O ' HD13 ' A' ' 27' ' ' LEU . 85.6 m-20 -65.45 -47.9 74.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.033 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 6.2 mt -58.36 -52.47 65.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.034 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.1 m -52.62 -45.63 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.403 ' N ' HG23 ' A' ' 25' ' ' VAL . 40.8 t -73.92 -44.75 50.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.878 0.37 . . . . 0.0 110.889 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.9 OUTLIER -61.24 -21.6 64.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.337 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -70.03 -32.69 70.97 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.714 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.83 -33.41 68.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.52 -0.763 . . . . 0.0 109.431 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.42 -41.3 76.55 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.43 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.5 t -66.14 -38.73 88.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.141 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -66.65 -40.03 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -42.46 97.36 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.306 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.423 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.54 -49.12 76.5 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.643 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.05 -22.24 66.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.984 -0.608 . . . . 0.0 110.023 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.475 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 m-70 -74.47 -33.14 62.8 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.583 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.16 -34.31 61.44 Favored Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 179.004 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.643 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.2 tt -78.05 -35.94 20.97 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.206 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.565 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.905 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.51 -38.61 59.33 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.371 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.905 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.45 -39.15 81.57 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.803 0.335 . . . . 0.0 111.2 -178.848 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 10.7 m-85 -77.37 -32.82 55.19 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.606 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.655 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.77 -46.75 84.12 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.413 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.96 -54.18 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.028 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -76.13 -54.35 6.96 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 -177.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.505 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.37 -38.24 60.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 113.959 -1.473 . . . . 0.0 114.501 -175.449 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.34 16.35 0.08 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.12 0.418 . . . . 0.0 111.904 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.97 156.73 0.71 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.53 7.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.9 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TRP . . . . . 0.509 ' H ' ' C ' ' A' ' 47' ' ' ALA . 25.1 m95 -90.65 -24.43 20.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.679 0.276 . . . . 0.0 110.854 178.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -27.67 67.15 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.177 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 48' ' ' ALA . 44.4 pt -68.19 -28.9 42.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.741 0.305 . . . . 0.0 110.809 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -54.37 -34.98 62.29 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.677 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.85 30.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.408 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -127.11 98.85 5.46 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.752 0.787 . . . . 0.0 110.442 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.2 mm? -75.01 -18.89 60.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.778 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.25 -53.82 0.17 Allowed Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 87.0 Cg_exo -48.35 -44.88 28.24 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.639 1.559 . . . . 0.0 112.109 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.59 -47.61 44.82 Favored Glycine 0 CA--C 1.505 -0.555 0 CA-C-N 115.798 -0.637 . . . . 0.0 113.408 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.42 83.98 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.94 -0.63 . . . . 0.0 111.53 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.01 -32.73 74.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.162 0.506 . . . . 0.0 110.054 178.944 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.655 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.6 m-85 -76.15 -46.49 28.38 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.195 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.57 85.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.584 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.5 t80 -71.26 -55.65 7.65 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -78.15 -23.56 47.69 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.674 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.82 -30.21 48.77 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.605 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -91.27 -29.68 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.657 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.52 -50.82 56.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.929 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 39.0 Cg_endo -64.47 -39.77 27.13 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 123.02 2.48 . . . . 0.0 112.126 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tt -57.67 -54.8 42.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.69 -52.73 64.24 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.469 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.54 -50.86 52.24 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 49.9 tp -57.06 -44.73 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.614 0.245 . . . . 0.0 111.497 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 mt -71.29 -38.32 71.8 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pp -82.5 -19.69 38.25 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 110.438 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.489 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -94.86 -8.58 36.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.3 tp . . . . . 0 C--O 1.231 0.111 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.55 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.686 0.203 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.22 -58.09 6.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.172 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -60.89 -43.73 98.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.94 -42.55 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.975 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.37 96.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.99 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.7 mtp -63.77 -31.64 72.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.774 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.45 -39.7 92.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -64.23 -48.2 76.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.292 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -58.8 -49.27 78.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.14 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -60.91 -33.84 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.17 -35.95 76.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -73.73 -34.83 64.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.984 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.54 -43.14 70.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.894 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -64.35 -32.06 73.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.163 0.506 . . . . 0.0 110.287 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -66.78 -53.32 34.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.874 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -47.37 72.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.793 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLU . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.2 pt-20 -64.45 -31.37 72.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.923 0.392 . . . . 0.0 111.027 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ASN . . . . . 0.625 ' O ' HD13 ' A' ' 27' ' ' LEU . 6.4 m-20 -66.75 -53.14 36.33 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.771 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt -50.06 -52.16 36.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 22' ' ' GLU . 29.6 m -55.29 -40.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' VAL . . . . . 0.613 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -80.11 -40.66 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.353 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -61.89 -27.14 68.59 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.15 -39.09 82.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.375 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -69.08 -33.82 74.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.247 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.45 -43.85 72.44 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.2 t -65.28 -36.93 85.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.429 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.7 OUTLIER -67.87 -43.3 86.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.987 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ALA . . . . . 0.419 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.73 -43.42 97.91 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.915 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.04 -49.8 71.65 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.447 -0.882 . . . . 0.0 111.206 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.51 -21.26 66.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.085 -0.557 . . . . 0.0 110.215 178.294 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.469 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 m-70 -75.73 -32.7 60.14 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.65 59.84 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.959 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.6 tt -77.75 -36.86 23.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.52 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.68 -37.19 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -70.32 -38.57 74.96 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 120.865 0.364 . . . . 0.0 111.061 -178.92 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -77.42 -33.56 54.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.54 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.548 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.17 -47.2 81.79 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.308 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.5 t -70.01 -54.2 20.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.138 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -76.42 -54.37 6.83 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.92 -45.71 48.86 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.484 -175.232 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' CYS . . . . . 0.523 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 31.6 t -59.27 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.463 -178.842 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.49 -142.39 0.44 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.11 9.08 9.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.948 0.404 . . . . 0.0 110.625 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -90.52 -25.19 20.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.1 p90 -66.08 -26.69 67.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.216 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.43 -28.6 41.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.841 0.353 . . . . 0.0 110.671 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -54.46 -52.34 62.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.143 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.6 42.22 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.31 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.482 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 9.8 ptp180 -147.75 96.28 2.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.635 0.731 . . . . 0.0 111.546 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.512 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -71.41 -18.02 62.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.793 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.547 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.36 -52.41 0.17 Allowed Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PRO . . . . . 0.58 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -47.63 -45.18 24.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 121.284 1.323 . . . . 0.0 111.944 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -48.89 44.24 Favored Glycine 0 CA--C 1.505 -0.551 0 CA-C-N 115.941 -0.572 . . . . 0.0 113.523 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.68 88.23 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.938 -0.631 . . . . 0.0 111.373 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.2 -33.97 77.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.212 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' TYR . . . . . 0.58 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.7 m-85 -74.53 -43.21 56.9 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.812 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.2 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.023 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.0 m-85 -71.13 -54.77 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -77.85 -23.6 48.86 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.58 -29.49 48.33 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 119.888 -1.148 . . . . 0.0 111.617 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.01 -28.5 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.7 -50.44 73.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 114.944 -1.026 . . . . 0.0 111.048 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.6 Cg_endo -65.18 -38.93 25.34 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.082 2.522 . . . . 0.0 112.171 -178.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 1.7 tm? -57.55 -56.49 21.18 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.64 -50.73 71.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.085 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.494 HD13 ' HB1' ' A' ' 30' ' ' ALA . 63.6 mt -49.82 -53.43 25.48 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LEU . . . . . 0.556 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.7 tt -57.21 -42.99 82.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.542 0.21 . . . . 0.0 111.482 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.6 mm? -72.02 -38.2 69.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.809 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.65 -20.74 35.68 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.406 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ALA . . . . . 0.56 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -93.25 -4.74 51.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 109.464 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.3 tp . . . . . 0 CA--C 1.529 0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.103 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.483 0.891 0 N-CA-C 111.089 -0.389 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.479 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 2.0 pt? -71.03 -17.7 62.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.52 -33.87 60.68 Favored Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.352 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.638 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 48.9 m -57.9 -50.91 85.48 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.864 0.332 . . . . 0.0 111.864 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 34.8 Cg_exo -61.32 -35.5 83.83 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.126 1.884 . . . . 0.0 112.186 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.95 -38.28 90.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.682 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.96 -31.73 68.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.567 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.24 -40.97 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.217 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.22 83.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.263 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -68.25 -38.66 82.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -60.76 -41.76 96.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.034 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -63.34 -30.54 71.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.802 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -70.24 -47.94 59.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.55 -31.26 72.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -72.09 -32.48 67.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -75.85 -40.93 53.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -68.19 -41.95 80.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.876 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HD3' ' O ' ' A' ' 19' ' ' LYS . 6.8 tmtm? -63.51 -37.0 85.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.637 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.77 -53.0 46.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.155 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.498 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.38 -46.6 73.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.877 -179.084 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.552 ' HG3' HD22 ' A' ' 23' ' ' ASN . 12.3 pt-20 -65.68 -32.47 74.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.741 0.305 . . . . 0.0 111.399 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.661 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -67.07 -54.49 20.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.746 0.308 . . . . 0.0 111.256 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.7 mt -50.72 -52.02 44.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' GLU . 32.7 m -54.84 -42.75 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.6 t -77.01 -51.64 18.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.61 0.243 . . . . 0.0 111.48 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -53.51 -35.13 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -62.38 -38.01 87.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.307 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.686 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -67.34 -32.57 73.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.763 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.466 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.68 -41.27 75.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.304 0.573 . . . . 0.0 109.508 177.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.1 t -67.39 -36.91 82.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.359 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -68.25 -43.63 84.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.96 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.429 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -61.32 -42.87 99.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.91 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.413 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -63.15 -49.67 69.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.117 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.565 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.53 -20.66 66.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.102 178.16 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.8 m-70 -75.79 -31.9 59.66 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.58 -33.47 58.24 Favored Glycine 0 N--CA 1.435 -1.393 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.097 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.9 tt -78.25 -35.99 20.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.45 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.18 -36.49 58.66 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -70.97 -38.26 72.76 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 120.798 0.332 . . . . 0.0 111.015 -178.892 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.69 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.48 -33.5 54.51 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.471 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.694 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -57.93 -46.47 84.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.971 0.891 . . . . 0.0 108.698 176.238 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 39' ' ' LEU . 89.0 t -70.42 -53.26 23.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.093 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -76.21 -54.39 6.87 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.82 -45.7 34.49 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 113.886 -1.507 . . . . 0.0 114.556 -175.266 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 16.1 t -54.9 -80.85 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.054 0.388 . . . . 0.0 111.356 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 51.16 -147.98 0.38 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.447 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.3 7.87 9.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.928 0.394 . . . . 0.0 110.865 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -90.97 -25.39 19.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.191 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.27 -26.29 64.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.563 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 48' ' ' ALA . 38.9 pt -68.9 -29.48 43.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.823 0.344 . . . . 0.0 111.055 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -55.08 -39.16 68.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.839 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 162.33 34.06 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.881 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.2 ttm180 -129.12 95.98 4.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.876 0.846 . . . . 0.0 110.569 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 58' ' ' GLY . 44.8 mt -75.64 -20.11 58.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.726 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.48 -54.82 0.2 Allowed Pre-proline 0 N--CA 1.47 0.542 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.5 Cg_exo -48.74 -42.9 35.95 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.696 1.597 . . . . 0.0 112.056 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.76 -49.24 41.77 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.42 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.52 -38.91 91.81 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.896 -0.652 . . . . 0.0 111.262 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.69 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.91 -35.56 80.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.343 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.694 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.7 m-85 -73.57 -43.13 60.58 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.826 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.9 -39.31 83.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.013 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -70.76 -54.85 10.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -78.12 -23.28 47.9 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.22 -29.87 48.47 Favored Glycine 0 CA--C 1.518 0.263 0 C-N-CA 119.736 -1.221 . . . . 0.0 111.521 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.27 -27.21 4.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.667 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.17 -49.95 78.43 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.913 178.534 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.8 Cg_endo -65.78 -38.05 25.35 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.161 2.574 . . . . 0.0 112.071 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.74 -55.13 39.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -56.24 -51.12 69.28 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.783 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.466 HD13 ' HB1' ' A' ' 30' ' ' ALA . 77.5 mt -51.21 -49.41 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.387 0.429 . . . . 0.0 111.667 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.655 HD12 HD23 ' A' ' 27' ' ' LEU . 31.0 tp -57.12 -45.76 83.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.712 0.291 . . . . 0.0 111.229 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.25 -38.61 71.91 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -81.59 -23.62 36.97 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.733 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.632 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -91.42 -0.38 57.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.41 0.624 . . . . 0.0 109.377 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.54 HD12 ' HD2' ' A' ' 77' ' ' PRO . 18.9 tp -109.33 135.61 20.25 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.366 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.54 ' HD2' HD12 ' A' ' 76' ' ' LEU . 75.4 Cg_exo -49.98 158.3 2.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.508 2.138 . . . . 0.0 112.439 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.499 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 31.0 Cg_endo -62.75 -50.79 3.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.351 2.034 . . . . 0.0 113.023 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -64.64 -23.04 67.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.948 0.404 . . . . 0.0 110.978 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.496 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -76.72 -47.14 22.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.361 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.499 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -74.04 -24.54 59.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.882 0.372 . . . . 0.0 110.42 -179.676 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.52 65.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.85 -18.71 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.89 -10.6 56.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -90.74 148.61 22.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.049 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 65.6 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.965 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 111.222 -0.338 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.12 -18.65 63.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.077 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.81 -33.75 59.93 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.254 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.489 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 63.1 m -52.13 -51.3 72.9 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 5' ' ' SER . 36.2 Cg_endo -66.22 -28.84 47.62 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 121.939 1.759 . . . . 0.0 112.658 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.43 -49.61 70.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -67.23 -42.45 83.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.218 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.21 -36.75 80.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.13 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.7 -37.09 67.94 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.3 tpp -65.91 -34.88 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -66.0 -35.79 81.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -64.64 -41.99 95.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.695 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -64.95 -48.73 73.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.108 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -63.49 -33.29 75.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.422 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.07 -33.91 65.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.066 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -73.79 -40.76 63.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.965 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.98 -35.32 76.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.948 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -66.0 -40.71 91.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.76 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.586 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.31 -48.12 74.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.62 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -49.52 69.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.44 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.64 -31.46 71.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.366 . . . . 0.0 110.723 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.626 ' O ' HD13 ' A' ' 27' ' ' LEU . 26.8 t-20 -61.42 -53.86 51.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.968 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.8 mt -55.55 -39.88 71.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.799 0.333 . . . . 0.0 110.672 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.74 -46.12 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.909 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.4 t -73.6 -41.05 55.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.538 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.1 mp -58.6 -27.6 64.81 Favored 'General case' 0 CA--C 1.522 -0.102 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -69.81 -32.57 71.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.218 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.32 -36.05 63.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.884 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.49 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.09 -40.41 78.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.3 t -67.66 -39.42 84.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.276 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.6 -41.59 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.08 97.3 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.457 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.31 -49.97 69.29 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.183 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.603 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.96 -20.18 65.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.32 -0.44 . . . . 0.0 110.262 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.8 m-70 -75.77 -31.68 59.61 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.639 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.61 -31.5 56.28 Favored Glycine 0 N--CA 1.433 -1.564 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.511 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.688 ' O ' HD13 ' A' ' 42' ' ' LEU . 13.9 tt -78.43 -35.11 18.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.215 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.807 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.94 -35.79 50.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.896 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.807 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.8 p -71.52 -37.96 71.14 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.072 0.463 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.647 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.6 m-85 -75.56 -35.9 60.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.483 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.2 mp -56.89 -43.71 81.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 39' ' ' LEU . 82.2 t -70.86 -47.79 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.751 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.47 -53.7 8.23 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -178.103 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.72 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 17.0 m-85 -80.98 -48.15 12.66 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.588 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.0 t -62.19 1.99 0.27 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.703 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.536 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -44.54 153.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.413 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.94 5.69 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.536 ' H ' ' C ' ' A' ' 47' ' ' ALA . 38.8 m95 -90.2 -23.49 21.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.603 0.24 . . . . 0.0 111.076 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.478 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.03 -14.09 62.83 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.865 0.364 . . . . 0.0 110.755 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 48' ' ' ALA . 14.6 pt -68.55 -26.9 34.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.511 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -52.35 -39.77 61.12 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.357 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.08 39.14 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.986 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.567 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.5 ptt180 -135.11 102.34 5.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.751 0.786 . . . . 0.0 111.619 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.533 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -73.17 -17.5 61.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.522 178.589 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.05 -51.86 0.15 Allowed Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.72 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.1 Cg_exo -47.82 -48.5 15.85 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.418 1.412 . . . . 0.0 112.019 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.57 -48.26 28.73 Favored Glycine 0 CA--C 1.508 -0.37 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.066 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.94 93.81 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.357 -0.421 . . . . 0.0 111.969 -178.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.647 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.47 -31.5 72.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.313 0.578 . . . . 0.0 110.175 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.656 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -78.05 -45.13 24.42 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.207 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -35.87 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.239 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.4 t80 -71.33 -55.29 8.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.328 -179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.807 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -78.33 -23.19 47.12 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.483 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -79.31 -29.39 49.99 Favored Glycine 0 CA--C 1.517 0.194 0 C-N-CA 119.994 -1.098 . . . . 0.0 111.29 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.82 -28.46 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.29 -49.91 73.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.669 178.72 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.4 Cg_endo -62.75 -39.51 42.27 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.887 2.391 . . . . 0.0 111.611 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 73' ' ' LEU . 10.1 tt -57.36 -59.41 5.18 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.0 mp -51.02 -50.82 57.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.729 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 ' HB1' ' A' ' 30' ' ' ALA . 98.2 mt -52.62 -45.6 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.275 0.36 . . . . 0.0 111.75 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.19 -44.74 95.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.341 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.4 mp -71.54 -38.58 71.04 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -80.57 -28.04 37.31 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.553 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.87 -0.04 55.78 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.617 HD12 ' HD2' ' A' ' 77' ' ' PRO . 39.6 tp -116.54 129.49 25.23 Favored Pre-proline 0 C--O 1.231 0.117 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.91 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.617 ' HD2' HD12 ' A' ' 76' ' ' LEU . 88.3 Cg_exo -48.31 132.1 23.5 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.016 1.811 . . . . 0.0 111.493 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.64 -36.43 50.4 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.515 2.143 . . . . 0.0 112.369 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -66.77 -29.44 69.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.28 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.476 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -71.15 -55.31 8.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.078 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.494 ' HB2' HD23 ' A' ' 76' ' ' LEU . 14.2 t80 -68.63 -19.44 64.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.121 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.04 -49.97 45.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.985 0.421 . . . . 0.0 110.575 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.47 -11.32 60.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.113 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -87.18 -13.6 43.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.22 139.36 30.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.207 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.7 p . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.986 179.98 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.484 0.939 0 N-CA-C 111.194 -0.349 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 3' ' ' LEU . 8.7 mp -71.56 -18.96 62.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.167 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.26 -33.76 58.68 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.2 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.495 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 49.7 m -54.0 -50.67 82.87 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 5' ' ' SER . 55.5 Cg_endo -69.45 -38.75 8.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.096 1.864 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.25 -45.28 93.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.497 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -69.3 -37.23 77.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.185 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.92 -33.52 73.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.294 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.77 -41.48 62.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.76 -32.0 73.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.796 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.95 -37.27 83.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.745 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -64.22 -45.26 89.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.001 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -61.85 -51.09 69.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -60.45 -39.97 89.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.267 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.33 -34.74 78.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.096 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -74.3 -37.27 63.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -70.55 -32.88 70.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.981 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -72.23 -38.33 68.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.826 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.94 -50.36 56.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.96 -48.68 72.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.271 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.8 pt-20 -63.96 -33.98 76.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.622 0.248 . . . . 0.0 110.794 -179.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.564 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 82.1 m-20 -58.83 -52.55 65.26 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 2.4 mt -48.17 -50.4 29.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.524 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.1 t -49.75 -53.92 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.276 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.56 -45.66 77.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 73.3 mt -61.52 -24.34 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.705 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -67.27 -30.4 70.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.84 -31.28 66.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.007 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.98 76.71 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.459 ' HB2' HD21 ' A' ' 72' ' ' LEU . 33.7 t -65.32 -43.27 91.54 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.997 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -62.28 -40.43 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.51 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.18 99.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.608 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.75 -49.54 75.12 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.612 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.81 -19.94 65.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.146 -0.527 . . . . 0.0 110.352 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.463 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.7 m-70 -76.17 -31.57 58.58 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.26 -32.0 56.37 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.531 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 35' ' ' ALA . 12.9 tt -77.67 -36.2 22.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.285 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.811 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.08 -36.29 55.92 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.811 ' N ' HD12 ' A' ' 39' ' ' LEU . 48.6 p -71.15 -36.37 72.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 110.649 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 17.0 m-85 -78.23 -35.98 47.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -55.74 -46.11 77.86 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.92 0.867 . . . . 0.0 108.709 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.8 t -70.33 -49.36 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.123 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.4 m-85 -75.98 -54.0 7.53 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.697 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 6.8 m-85 -77.18 -48.68 16.97 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 40.4 t -53.1 -81.28 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.568 -175.459 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 41.51 -141.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.458 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 13.11 9.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.885 0.374 . . . . 0.0 110.729 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 20.1 m95 -91.18 -26.27 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.264 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.501 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -69.02 -31.55 70.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.332 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.8 pt -61.34 -28.15 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.873 0.368 . . . . 0.0 110.436 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -54.06 -50.89 65.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.077 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.25 40.62 0.04 OUTLIER Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.035 -1.079 . . . . 0.0 113.877 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.563 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 8.0 ptm180 -148.39 105.46 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.741 0.782 . . . . 0.0 111.83 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.432 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.3 pp -74.46 -17.8 60.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.597 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.81 -51.98 0.15 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.697 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 90.7 Cg_exo -47.86 -49.17 14.26 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.331 1.354 . . . . 0.0 111.878 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -49.15 -49.68 29.98 Favored Glycine 0 CA--C 1.505 -0.564 0 CA-C-N 115.995 -0.548 . . . . 0.0 113.616 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.67 -42.42 99.61 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.017 -0.592 . . . . 0.0 111.619 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.43 -36.97 76.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.296 0.57 . . . . 0.0 110.217 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.633 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.2 m-30 -72.07 -46.49 56.67 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.025 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.8 88.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.704 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.612 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.4 m-85 -71.51 -54.18 11.41 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.82 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.66 -24.59 49.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.78 -31.54 43.97 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.54 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.26 -25.79 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.632 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.05 -51.69 59.64 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.639 178.331 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.82 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.72 -39.4 26.76 Favored 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 122.95 2.434 . . . . 0.0 112.257 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tt -58.26 -54.42 47.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.844 0.354 . . . . 0.0 110.415 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 74' ' ' LEU . 6.4 tp -58.01 -53.8 54.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.37 -52.57 27.46 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 27' ' ' LEU . 2.7 mm? -57.55 -45.08 85.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 85.5 mt -69.62 -38.45 77.23 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.538 HD23 ' HG ' ' A' ' 70' ' ' LEU . 1.7 pp -82.27 -19.97 38.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.028 0.442 . . . . 0.0 110.201 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.95 -7.17 43.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.761 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.593 HD12 ' HD2' ' A' ' 77' ' ' PRO . 17.2 tp -99.93 134.97 20.58 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.129 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.593 ' HD2' HD12 ' A' ' 76' ' ' LEU . 88.3 Cg_exo -45.22 152.85 0.61 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.585 2.19 . . . . 0.0 112.873 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.488 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 31.4 Cg_exo -58.97 -50.78 8.13 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.525 2.15 . . . . 0.0 113.044 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -63.6 -25.93 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.407 . . . . 0.0 110.976 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.49 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.32 -47.63 26.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.63 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -76.17 -28.11 57.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.757 0.313 . . . . 0.0 110.992 -179.299 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.79 -45.68 70.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.632 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.9 -18.41 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.767 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.09 -14.69 59.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.049 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.79 143.06 27.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.136 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.818 -179.886 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.484 0.923 0 N-CA-C 111.283 -0.314 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 3' ' ' LEU . 2.6 pt? -68.43 -18.57 64.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.198 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.52 -36.12 59.1 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.312 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 65.7 m -54.31 -51.11 80.77 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 5' ' ' SER . 59.3 Cg_endo -71.9 -28.48 16.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.302 2.002 . . . . 0.0 112.682 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.59 -56.12 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.468 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -68.18 -31.38 70.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.525 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -44.27 83.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.52 -27.6 63.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.055 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.9 ttt -73.7 -38.19 64.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.12 -33.32 75.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.836 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -69.17 -37.62 78.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -69.35 -42.07 75.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.795 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -66.26 -43.86 85.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.947 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.68 -38.37 90.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.945 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -70.73 -36.65 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.828 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -70.72 -34.22 71.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.056 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -71.1 -39.44 72.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.25 -47.8 75.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -56.14 -49.64 73.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.634 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.47 -33.25 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.76 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.464 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.7 m120 -60.7 -41.09 94.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.434 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.6 mt -59.51 -48.34 82.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 110.786 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.452 HG23 ' H ' ' A' ' 25' ' ' VAL . 3.4 t -49.87 -53.58 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.371 -178.681 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.612 HG23 HD13 ' A' ' 27' ' ' LEU . 4.8 m -71.49 -39.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.424 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.612 HD13 HG23 ' A' ' 26' ' ' VAL . 1.5 mp -63.66 -24.24 67.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.285 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -69.53 -32.11 70.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.722 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.53 -33.9 67.19 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.725 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.47 -43.79 72.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.281 0.562 . . . . 0.0 109.623 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.423 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -64.18 -38.67 91.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.203 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.722 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.6 OUTLIER -66.26 -40.56 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.448 179.023 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.28 93.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.514 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.14 77.18 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 178.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.567 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.08 -20.47 66.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.085 -0.558 . . . . 0.0 110.109 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.471 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.3 m-70 -75.99 -32.32 59.4 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.07 -34.08 58.85 Favored Glycine 0 N--CA 1.433 -1.542 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.888 178.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 35' ' ' ALA . 17.5 tt -77.27 -37.22 25.28 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.359 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.25 -38.23 60.62 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.54 -38.57 77.53 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.252 -178.69 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.0 m-85 -77.68 -33.49 53.25 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.577 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.28 -47.07 82.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.919 0.866 . . . . 0.0 108.838 176.468 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.83 -54.41 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.169 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -76.36 -54.42 6.78 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.541 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.32 -46.0 52.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 113.877 -1.51 . . . . 0.0 114.395 -175.347 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.533 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -60.02 -81.42 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.445 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.76 -141.08 0.36 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -119.08 9.97 11.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 -90.26 -27.94 19.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.2 p90 -66.85 -40.21 87.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.824 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -28.73 45.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -54.82 -52.05 63.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.825 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.02 44.77 0.06 OUTLIER Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.375 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 17.2 ptp180 -157.68 102.44 1.87 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.696 0.76 . . . . 0.0 111.653 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 pp -73.9 -18.38 60.91 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.167 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.17 -52.99 0.17 Allowed Pre-proline 0 N--CA 1.47 0.534 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.1 Cg_exo -48.37 -42.9 33.68 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 121.486 1.457 . . . . 0.0 112.16 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -46.91 48.77 Favored Glycine 0 CA--C 1.505 -0.535 0 CA-C-N 115.905 -0.588 . . . . 0.0 113.105 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.06 89.7 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.804 -0.698 . . . . 0.0 111.447 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.62 -32.06 73.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.02 0.438 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.572 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -76.37 -49.35 17.05 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.333 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.25 93.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.836 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.5 t80 -71.15 -54.71 10.1 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.81 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.57 -23.94 49.89 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.789 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.52 -29.47 48.71 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.672 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 p -91.28 -29.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.76 -50.43 73.58 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.187 179.123 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.81 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.37 -40.46 24.75 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 C-N-CA 122.962 2.442 . . . . 0.0 112.075 -178.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.93 -54.75 43.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.382 . . . . 0.0 110.01 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.7 mt -57.97 -53.34 59.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.411 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 86.7 mt -49.58 -52.87 27.16 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.433 0.458 . . . . 0.0 112.11 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 58.8 tp -56.81 -46.21 81.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.634 0.254 . . . . 0.0 111.614 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.6 -37.96 77.11 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.62 -21.72 35.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.002 0.429 . . . . 0.0 110.243 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.529 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -91.25 -10.41 41.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.581 178.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.67 HD12 ' HD2' ' A' ' 77' ' ' PRO . 24.8 tp -94.2 133.47 27.3 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.67 ' HD2' HD12 ' A' ' 76' ' ' LEU . 96.0 Cg_exo -43.51 152.3 0.3 Allowed 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.709 2.273 . . . . 0.0 112.905 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.465 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 32.0 Cg_exo -57.86 -53.33 4.55 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.448 2.099 . . . . 0.0 113.07 -179.435 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -63.26 -25.45 68.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.999 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.443 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.49 -46.88 29.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.577 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.465 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.5 OUTLIER -75.72 -21.52 57.44 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.459 -179.511 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.53 -45.22 62.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.595 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.14 -16.26 63.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.742 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.79 -12.3 53.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.888 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.22 -176.84 4.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.161 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.81 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.481 0.793 0 N-CA-C 111.053 -0.403 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.406 ' C ' ' HD2' ' A' ' 6' ' ' PRO . 39.8 tp -66.4 -18.57 65.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.897 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.42 -33.66 61.14 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.198 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 59.9 m -54.26 -51.26 79.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.249 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 5' ' ' SER . 60.0 Cg_endo -72.38 -28.26 15.16 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.044 1.829 . . . . 0.0 112.008 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.06 -43.45 98.87 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.047 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -69.22 -47.75 63.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.78 -37.07 78.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.277 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.44 -32.55 64.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.453 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 44.2 ttp -69.54 -45.48 68.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.016 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.12 -31.44 71.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.755 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -66.61 -40.71 88.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.737 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LYS . . . . . 0.408 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 24.6 ttmm -64.26 -48.0 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.706 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.35 -24.26 66.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.17 -53.18 13.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.093 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 14' ' ' LYS . 3.0 p30 -67.63 -30.81 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.978 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -68.83 -45.64 70.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.014 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -64.9 -36.56 84.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -63.72 -51.3 65.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.9 -49.51 71.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.638 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.409 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.4 pt-20 -63.68 -35.07 79.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.724 0.297 . . . . 0.0 111.141 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.479 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.9 m120 -59.82 -43.76 94.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.687 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.9 mt -58.08 -48.58 79.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.03 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.4 t -49.68 -53.69 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.193 -178.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.569 HG23 HD13 ' A' ' 27' ' ' LEU . 4.3 m -72.07 -38.64 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.59 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.569 HD13 HG23 ' A' ' 26' ' ' VAL . 1.9 mp -63.96 -24.85 67.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.272 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -70.01 -30.0 67.2 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.96 -34.77 66.71 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.419 178.464 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.12 78.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.1 t -66.71 -38.63 87.13 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -66.52 -41.66 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.86 94.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.487 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.6 -49.54 75.66 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.607 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.36 -22.16 66.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.067 -0.567 . . . . 0.0 110.238 178.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.2 m-70 -75.6 -31.76 60.05 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.569 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.25 -33.9 58.56 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.946 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 35' ' ' ALA . 20.0 tt -77.89 -36.57 22.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.512 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.7 -37.06 59.79 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.71 -38.82 77.09 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.623 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -77.6 -32.5 53.64 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.619 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.592 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.76 -46.75 84.1 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.12 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 91.9 t -69.9 -54.16 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 114.949 -1.023 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -76.23 -54.93 6.08 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -38.15 64.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 113.679 -1.601 . . . . 0.0 114.447 -175.301 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.489 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 7.4 t -70.57 16.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.849 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.526 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -50.18 156.59 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.85 8.79 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.526 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.83 -25.84 19.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.659 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.22 63.53 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.616 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 48' ' ' ALA . 30.7 pt -70.03 -29.26 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.287 . . . . 0.0 111.022 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -54.71 -29.91 54.57 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 149.52 30.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 113.138 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.0 ttm180 -122.52 98.77 6.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.825 0.821 . . . . 0.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.13 -18.87 60.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.404 179.219 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.9 -54.49 0.19 Allowed Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 79.8 Cg_exo -49.09 -45.09 30.74 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.492 1.462 . . . . 0.0 112.027 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.53 -47.26 45.17 Favored Glycine 0 CA--C 1.506 -0.524 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.345 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.57 94.87 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.945 -0.627 . . . . 0.0 111.496 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.623 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.96 -35.13 79.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 0.0 110.238 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.592 ' CE1' HD12 ' A' ' 42' ' ' LEU . 3.1 m-30 -73.15 -43.81 60.99 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.863 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.7 -39.44 84.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.007 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.3 m-85 -71.01 -54.64 10.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.828 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.1 m-85 -77.76 -24.06 49.1 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.36 45.7 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.056 -1.069 . . . . 0.0 111.721 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -91.13 -27.51 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.109 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.43 -50.57 75.76 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.114 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.828 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.6 Cg_endo -64.96 -40.51 20.49 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.112 2.541 . . . . 0.0 112.155 -178.096 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -55.79 30.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.107 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.03 -52.61 64.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.223 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 71.7 mt -49.63 -53.64 22.98 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.362 0.414 . . . . 0.0 112.073 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.452 HD12 HD23 ' A' ' 27' ' ' LEU . 40.2 tp -57.59 -44.7 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.45 -39.67 81.38 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.3 pp -82.65 -20.15 36.86 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.214 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.496 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.15 -9.51 42.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.523 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.642 HD12 ' HD2' ' A' ' 77' ' ' PRO . 17.5 tp -97.75 133.46 23.42 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.114 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.642 ' HD2' HD12 ' A' ' 76' ' ' LEU . 91.4 Cg_exo -44.79 148.02 1.63 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.577 2.185 . . . . 0.0 112.517 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.52 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 14.6 Cg_endo -56.6 -48.31 19.51 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.559 2.173 . . . . 0.0 112.859 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -61.21 -29.27 69.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.863 0.363 . . . . 0.0 110.885 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.498 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.0 -50.44 16.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.068 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.52 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -72.93 -23.27 60.67 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.979 -179.163 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.28 -43.4 64.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.825 0.345 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.95 -16.35 63.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.002 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -89.12 -13.03 39.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.919 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.48 140.44 33.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.8 m . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.886 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 111.017 -0.416 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 66.4 tp -71.83 -24.37 61.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.162 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.69 -33.49 60.49 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.012 -0.613 . . . . 0.0 113.432 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.456 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 48.1 t -56.15 -51.16 82.92 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -178.911 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 5' ' ' SER . 57.0 Cg_endo -71.26 -34.64 9.65 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.031 1.821 . . . . 0.0 112.568 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.31 -38.82 84.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.81 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -71.54 -35.47 70.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.85 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.91 -34.91 74.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.089 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.55 -48.85 45.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.427 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 91.6 mtp -59.89 -43.62 94.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.99 -37.22 76.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.02 -51.2 70.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -60.2 -36.71 78.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -66.34 -37.73 86.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.688 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.55 -45.13 76.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.9 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -67.93 -31.95 72.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' HD23 ' A' ' 21' ' ' LEU . 15.6 t70 -67.96 -49.54 61.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.815 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -62.57 -28.59 69.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.719 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.16 66.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.472 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.72 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.1 pp -62.4 -44.13 97.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.68 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 11.9 pt-20 -68.44 -37.58 80.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.795 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.61 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.7 m-20 -66.15 -55.02 18.42 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.973 -179.759 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.7 tp -52.23 -52.0 55.0 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 21' ' ' LEU . 18.8 m -52.34 -44.49 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.442 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.0 t -75.46 -41.18 42.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.796 0.332 . . . . 0.0 110.993 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 87.2 mt -63.7 -22.43 66.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.412 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -69.65 -30.39 68.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.736 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.44 -33.63 65.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.442 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.03 76.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.6 t -65.53 -41.08 93.47 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.06 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.736 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.65 -38.89 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.75 97.9 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.277 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.47 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.11 -49.65 72.93 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.47 -21.21 66.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.926 -0.637 . . . . 0.0 110.254 178.359 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.464 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.4 m-70 -75.59 -31.75 60.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.28 -32.95 57.51 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.861 178.633 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.591 ' O ' HD13 ' A' ' 42' ' ' LEU . 14.0 tt -77.92 -36.08 21.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.335 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.85 -35.97 57.12 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.989 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.808 ' N ' HD12 ' A' ' 39' ' ' LEU . 32.8 p -70.83 -38.14 73.23 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.071 0.462 . . . . 0.0 110.537 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.628 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 16.4 m-85 -76.01 -35.24 59.62 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.389 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.591 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.5 mp -56.21 -45.49 79.84 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.941 0.877 . . . . 0.0 108.763 176.603 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.4 t -70.98 -48.22 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.097 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.77 -53.84 7.87 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -177.804 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.681 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.4 m-85 -78.82 -48.71 14.24 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.485 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 29.4 t -52.5 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.029 -0.669 . . . . 0.0 111.913 -175.384 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 44.73 -143.16 0.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.41 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.74 12.18 9.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.976 0.417 . . . . 0.0 110.846 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.9 m95 -91.13 -28.64 17.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.208 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.519 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.26 -28.22 66.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.527 -179.18 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.9 pt -65.06 -28.9 45.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.329 . . . . 0.0 111.067 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -54.56 -32.01 57.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.034 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 150.57 44.88 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.608 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -141.78 100.96 3.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.644 0.735 . . . . 0.0 110.664 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.85 -20.03 58.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.249 178.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.66 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.96 -54.03 0.19 Allowed Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.681 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.6 Cg_exo -50.14 -47.89 22.08 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.694 1.596 . . . . 0.0 111.94 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.58 -48.03 29.02 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.747 -0.661 . . . . 0.0 113.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.91 -42.86 97.31 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.134 -0.533 . . . . 0.0 111.794 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.628 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.72 -34.7 73.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.304 0.573 . . . . 0.0 110.153 179.146 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.634 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -74.1 -46.24 44.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.969 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.98 92.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.632 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.34 -54.77 9.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.836 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.67 -24.31 49.39 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.7 -32.15 42.28 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.493 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.21 -26.11 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.12 -51.0 72.15 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.942 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.836 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.0 Cg_endo -64.44 -40.14 25.67 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 122.841 2.36 . . . . 0.0 112.132 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -57.92 -56.22 24.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.955 0.407 . . . . 0.0 110.342 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.0 mt -57.44 -54.15 50.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.426 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.4 mt -48.88 -50.95 32.46 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.395 0.434 . . . . 0.0 112.011 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 2.4 tt -59.21 -50.57 73.51 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.655 -179.307 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.451 HD13 ' CD2' ' A' ' 81' ' ' TYR . 12.3 tp -64.57 -37.71 88.51 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 2.0 pp -81.6 -24.34 36.5 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.377 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.51 -7.63 52.46 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.369 0.604 . . . . 0.0 109.525 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.654 HD22 ' HD2' ' A' ' 77' ' ' PRO . 2.4 tm? -114.46 127.02 27.24 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.496 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.654 ' HD2' HD22 ' A' ' 76' ' ' LEU . 60.4 Cg_exo -38.43 118.57 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.59 2.193 . . . . 0.0 112.432 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.05 -37.69 30.6 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.988 2.459 . . . . 0.0 113.223 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -68.35 -32.27 72.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.756 0.312 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.461 ' HB3' ' CD1' ' A' ' 76' ' ' LEU . . . -76.01 -45.39 34.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.47 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.503 ' HB2' HD12 ' A' ' 76' ' ' LEU . 3.9 t80 -70.41 -33.05 70.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.66 0.267 . . . . 0.0 111.088 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.54 -36.79 71.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.879 0.371 . . . . 0.0 110.723 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.72 -22.92 64.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.95 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -82.73 -3.42 56.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.052 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -88.5 145.15 25.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.132 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.904 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 111.115 -0.379 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 90.2 mt -71.26 -18.81 62.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.65 57.09 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.016 -0.612 . . . . 0.0 113.466 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.604 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 53.0 m -55.57 -50.73 85.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.604 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 51.5 Cg_exo -55.72 -28.74 68.0 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.122 1.881 . . . . 0.0 112.751 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.29 -46.6 82.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.706 0.288 . . . . 0.0 111.155 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -67.34 -36.99 82.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.08 -42.58 84.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.61 -43.41 98.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.989 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.0 ttt -62.87 -34.28 77.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.636 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.06 -42.56 99.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.984 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -63.63 -33.76 76.33 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -69.8 -52.64 23.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -61.09 -32.26 71.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.151 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.93 -31.53 68.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.857 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -77.41 -43.66 31.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.061 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.98 -34.43 78.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.283 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -68.23 -48.91 63.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.226 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.18 78.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.338 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.479 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.01 -46.46 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.546 -179.74 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.479 ' N ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -66.75 -37.11 83.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.677 0.275 . . . . 0.0 111.099 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 95.2 m-20 -63.13 -38.76 92.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.0 110.613 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.51 -53.65 55.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.454 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' LEU . 23.1 t -51.44 -48.22 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.494 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.567 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -73.32 -36.2 48.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.656 0.265 . . . . 0.0 111.074 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.567 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -65.92 -24.01 66.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.034 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.38 -30.6 68.63 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.731 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.32 -33.69 65.28 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.463 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.47 74.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.452 0.644 . . . . 0.0 109.346 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.1 m -65.23 -40.61 94.3 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.318 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.731 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -63.08 -39.62 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.5 -41.45 97.3 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.381 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.17 -49.74 71.9 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.625 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.75 -20.18 65.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.157 -0.522 . . . . 0.0 110.176 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.5 m-70 -75.72 -33.21 60.29 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.33 -32.91 59.48 Favored Glycine 0 N--CA 1.43 -1.748 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.43 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.642 ' O ' HD13 ' A' ' 42' ' ' LEU . 12.4 tt -77.46 -36.63 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.527 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.865 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.93 -38.85 57.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.26 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.865 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -71.19 -36.17 71.83 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.981 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 13.1 m-85 -76.1 -35.93 59.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.121 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.642 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.8 mp -56.05 -44.83 79.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.1 t -70.91 -48.28 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.941 -1.027 . . . . 0.0 112.048 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -53.77 8.12 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.87 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.742 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.8 m-85 -79.23 -47.72 15.46 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -176.543 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.545 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.2 t -60.78 -0.53 0.29 Allowed 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.549 -175.509 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.521 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -46.9 161.18 0.07 Allowed 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -62.77 10.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.521 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.29 -26.3 20.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.778 0.323 . . . . 0.0 110.532 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -69.48 -33.1 72.38 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.219 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.6 pt -59.56 -27.7 38.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.899 0.38 . . . . 0.0 110.687 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -53.27 -42.39 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.087 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.89 48.62 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.053 -1.07 . . . . 0.0 113.52 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 13.4 ptp180 -154.88 107.13 2.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.741 0.782 . . . . 0.0 111.708 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.459 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 4.4 pp -74.12 -16.84 61.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.618 178.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -23.99 -51.52 0.12 Allowed Pre-proline 0 N--CA 1.467 0.384 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.742 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 82.3 Cg_exo -47.39 -49.96 12.14 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 121.379 1.386 . . . . 0.0 111.823 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -48.39 -48.07 27.84 Favored Glycine 0 CA--C 1.509 -0.307 0 CA-C-N 115.879 -0.6 . . . . 0.0 113.905 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.27 97.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.141 -0.529 . . . . 0.0 112.049 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.189 0.519 . . . . 0.0 110.126 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.648 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -75.45 -45.03 41.13 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.179 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.05 83.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.693 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 23.5 t80 -71.19 -54.54 10.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.29 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.62 -23.77 49.73 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.833 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.02 -29.19 47.39 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.614 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -90.94 -29.08 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.693 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.81 -50.44 73.83 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.978 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.6 Cg_endo -63.84 -39.57 32.89 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.933 2.422 . . . . 0.0 111.902 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.1 -58.24 9.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.918 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 mp -56.62 -51.51 68.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.32 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.2 mt -49.33 -52.64 26.64 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 47.6 tp -59.31 -44.25 92.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.404 HD12 ' HB2' ' A' ' 81' ' ' TYR . 11.4 tp -70.34 -39.08 74.9 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.91 -25.79 34.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.005 0.431 . . . . 0.0 110.411 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.531 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -85.79 -8.55 58.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.697 HD12 ' HD2' ' A' ' 77' ' ' PRO . 33.8 tp -94.89 127.91 41.34 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.777 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.697 ' HD2' HD12 ' A' ' 76' ' ' LEU . 79.0 Cg_exo -41.44 151.63 0.14 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.931 2.421 . . . . 0.0 113.272 -179.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.495 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 53.2 Cg_exo -54.77 -55.49 3.22 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.55 2.167 . . . . 0.0 113.222 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -61.73 -27.57 68.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.828 0.346 . . . . 0.0 111.111 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.04 -46.27 36.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.929 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.495 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -76.89 -27.17 54.88 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.063 -178.936 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.27 -44.01 66.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.89 0.376 . . . . 0.0 110.661 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.68 -17.02 63.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -85.28 -12.93 51.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.101 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.12 163.24 18.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.192 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.111 179.892 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo . . . . . 0 N--CA 1.485 0.987 0 N-CA-C 111.166 -0.359 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 3.8 mm? -69.11 -18.0 63.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.159 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.81 -33.73 59.92 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.439 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.608 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 42.4 t -56.96 -50.86 85.76 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 45.3 Cg_exo -56.41 -28.62 73.84 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.069 1.846 . . . . 0.0 112.466 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -58.1 -50.35 73.78 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -64.19 -36.47 84.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -32.7 73.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.57 -36.79 60.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.082 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 85.9 mtp -70.54 -35.66 73.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.23 -35.71 81.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.789 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -67.03 -36.34 81.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.387 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -66.46 -50.23 64.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.607 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.96 -41.33 91.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.865 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -62.53 -32.62 73.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.588 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.26 -41.71 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.675 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -66.43 -31.39 72.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -72.53 -35.68 68.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.724 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.19 -48.22 68.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.433 ' O ' HG22 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -57.68 -49.5 76.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.5 -35.7 81.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.666 0.269 . . . . 0.0 111.567 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.481 ' O ' HD13 ' A' ' 27' ' ' LEU . 92.1 m-20 -65.87 -42.51 90.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.787 0.327 . . . . 0.0 111.012 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.08 -55.74 30.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 21' ' ' LEU . 2.3 m -52.81 -43.91 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.295 -178.123 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -72.1 -41.59 67.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.807 0.337 . . . . 0.0 110.946 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' HB3' HD23 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -64.67 -22.93 67.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.508 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -69.31 -34.25 74.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.713 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.16 65.71 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.723 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -44.69 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.286 0.565 . . . . 0.0 109.601 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 43.2 t -64.37 -39.6 94.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.212 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -64.5 -40.76 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.246 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.31 95.64 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.338 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.44 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.93 -49.36 76.39 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.609 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.01 -21.35 66.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.254 178.441 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 10.1 m-70 -75.96 -33.28 59.79 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.589 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.82 -33.42 60.17 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.924 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.609 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.9 tt -77.78 -36.77 22.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.479 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.886 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.49 -37.95 59.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.886 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.19 -38.47 78.65 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 120.75 0.309 . . . . 0.0 111.016 -178.778 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.559 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.0 m-85 -77.9 -32.78 51.94 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.459 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.523 HD12 ' CE1' ' A' ' 61' ' ' TYR . 0.9 OUTLIER -57.68 -46.99 83.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 122.024 0.916 . . . . 0.0 108.674 176.399 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 39' ' ' LEU . 90.6 t -70.15 -53.92 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.007 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -76.07 -54.28 7.08 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.31 -45.82 45.0 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.039 -1.437 . . . . 0.0 114.387 -175.331 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.547 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -61.09 -81.15 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.317 -179.008 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.97 -144.83 0.35 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.046 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.11 13.49 10.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.12 -35.3 14.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.011 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -63.2 -13.69 40.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.344 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.9 pt -67.05 -28.55 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.055 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -53.82 -29.6 41.46 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.684 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.11 30.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.749 . . . . 0.0 113.069 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.7 ttm180 -117.83 99.17 6.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.674 0.75 . . . . 0.0 110.253 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -74.71 -19.89 60.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.59 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.604 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.22 -54.21 0.19 Allowed Pre-proline 0 N--CA 1.467 0.418 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.0 Cg_exo -48.4 -45.83 25.33 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.589 1.526 . . . . 0.0 112.032 178.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.26 -47.03 43.48 Favored Glycine 0 CA--C 1.506 -0.496 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.411 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.29 95.93 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.9 -0.65 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.559 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.14 -33.38 74.37 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.108 0.48 . . . . 0.0 110.228 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.593 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-85 -75.26 -44.2 47.18 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.833 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.2 87.58 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.779 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.53 -54.65 9.85 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -77.68 -24.13 49.38 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.47 45.25 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.045 -1.074 . . . . 0.0 111.574 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.25 -26.74 5.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.35 -50.49 75.88 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.829 178.657 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.7 Cg_endo -64.06 -39.64 30.82 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 122.974 2.449 . . . . 0.0 111.973 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.29 -56.27 23.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.048 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -57.32 -52.81 63.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.418 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.2 mt -49.28 -52.9 24.62 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 3.2 tm? -56.59 -45.17 81.55 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.6 mt -71.14 -39.09 72.19 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.69 -21.02 38.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.969 0.414 . . . . 0.0 110.5 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.498 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -93.65 -8.99 39.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.88 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.572 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 5.1 tp -73.95 145.66 84.07 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.404 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.572 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 53.6 Cg_exo -52.65 161.76 2.81 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.886 1.724 . . . . 0.0 111.086 178.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.24 -62.18 0.24 Allowed 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 121.866 1.71 . . . . 0.0 113.347 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.3 mmt180 -63.03 -24.71 68.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.72 0.295 . . . . 0.0 111.298 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.98 -45.05 36.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.546 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.484 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -78.91 -24.43 44.1 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.583 -178.943 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.5 -43.92 65.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.419 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.44 -16.86 63.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.45 -16.25 56.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.798 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.06 171.82 11.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.14 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.965 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.484 0.95 0 N-CA-C 111.224 -0.337 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.414 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.8 mm? -71.49 -20.58 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.07 -33.74 59.17 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.939 -0.648 . . . . 0.0 113.26 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.499 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 63.5 m -54.95 -51.04 82.72 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 5' ' ' SER . 47.5 Cg_endo -68.98 -28.03 29.52 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.068 1.846 . . . . 0.0 112.492 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.34 -53.17 61.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -66.31 -38.79 88.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.354 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.69 84.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.56 -36.93 68.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.979 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 tpp -65.81 -41.61 91.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.43 -37.73 81.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.728 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -62.31 -43.45 98.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.673 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -62.9 -55.33 26.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.015 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -57.45 -32.51 67.0 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.377 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.06 -44.07 77.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -69.45 -33.1 72.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.75 -37.27 73.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.165 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -70.95 -34.79 71.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -68.72 -52.83 26.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.442 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.23 -45.19 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.496 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.7 pt-20 -66.95 -30.98 71.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.864 0.364 . . . . 0.0 110.736 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.48 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.3 m-20 -68.0 -42.33 80.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.232 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.9 mt -62.78 -51.51 66.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.737 0.303 . . . . 0.0 111.715 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.6 m -53.2 -45.43 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.535 HG13 HD13 ' A' ' 27' ' ' LEU . 8.3 p -74.91 -37.51 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.778 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.563 HD11 ' HB1' ' A' ' 75' ' ' ALA . 1.2 mp -64.32 -22.92 67.12 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.857 -0.424 . . . . 0.0 109.857 179.163 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -70.39 -31.2 68.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.294 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.726 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.14 -35.31 66.47 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.46 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.83 -38.89 80.16 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 32.9 t -66.81 -40.47 88.07 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.075 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.49 -39.24 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.021 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.4 98.94 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.387 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.425 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.84 -49.3 77.25 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.619 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -65.91 -21.59 66.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.071 -0.565 . . . . 0.0 110.284 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.45 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 8.1 m-70 -73.89 -31.9 63.33 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.54 -32.5 57.53 Favored Glycine 0 N--CA 1.434 -1.437 0 CA-C-N 114.086 -1.415 . . . . 0.0 111.006 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.6 tt -78.13 -35.97 20.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.279 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.814 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.11 -35.43 56.38 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.814 ' N ' HD12 ' A' ' 39' ' ' LEU . 34.0 p -70.22 -38.59 75.28 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.023 0.44 . . . . 0.0 110.969 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.658 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.9 m-85 -78.45 -34.0 48.05 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.849 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -57.04 -47.14 81.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.009 0.909 . . . . 0.0 108.711 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.8 t -70.26 -54.39 18.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.291 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -76.4 -54.56 6.56 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.497 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.44 -37.49 65.83 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 113.956 -1.474 . . . . 0.0 114.422 -175.303 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.488 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.56 16.18 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.089 0.404 . . . . 0.0 111.79 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -48.69 153.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.485 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -60.17 5.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.487 ' H ' ' C ' ' A' ' 47' ' ' ALA . 55.3 m95 -90.06 -24.83 21.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -22.05 63.89 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.161 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -69.09 -29.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.217 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -54.86 -42.88 72.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.628 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 164.76 30.65 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.066 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -120.98 97.01 5.33 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.855 0.836 . . . . 0.0 110.449 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 39.4 mt -75.14 -18.91 60.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.182 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.89 -53.72 0.19 Allowed Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 81.0 Cg_exo -49.52 -45.18 32.09 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.537 1.492 . . . . 0.0 112.056 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.38 -49.78 37.42 Favored Glycine 0 CA--C 1.505 -0.59 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.474 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.12 88.81 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.871 -0.665 . . . . 0.0 111.219 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.78 -36.84 84.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.241 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.581 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.5 m-85 -72.14 -43.87 63.99 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.765 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.3 87.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.893 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.643 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -71.46 -55.01 8.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.815 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -77.81 -24.16 48.85 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.44 -31.25 46.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 119.984 -1.103 . . . . 0.0 111.68 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -91.67 -26.47 5.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.64 -50.57 71.99 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.862 178.588 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.815 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 41.6 Cg_endo -64.79 -39.83 24.43 Favored 'Trans proline' 0 N--CA 1.448 -1.167 0 C-N-CA 122.978 2.452 . . . . 0.0 112.262 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.55 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.983 0.42 . . . . 0.0 110.339 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.2 mt -58.53 -53.83 53.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.096 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.9 mt -49.58 -51.67 35.52 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.347 0.404 . . . . 0.0 112.089 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.543 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.1 tt -58.2 -43.9 87.82 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 78.5 mt -70.99 -39.12 72.64 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -81.74 -23.2 36.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 110.353 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.563 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -89.83 -7.14 55.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.474 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tp -82.11 144.5 50.96 Favored Pre-proline 0 N--CA 1.456 -0.168 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.225 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.472 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.6 Cg_exo -54.32 148.87 39.81 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 121.882 1.722 . . . . 0.0 110.894 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.434 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 5.5 Cg_endo -47.85 -53.81 6.07 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.135 1.89 . . . . 0.0 113.056 -178.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.75 -25.9 68.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.836 0.351 . . . . 0.0 111.151 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.79 -47.21 26.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.676 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.434 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -76.11 -22.96 54.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.806 -179.223 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.34 60.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.807 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.0 -15.17 63.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.772 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.39 -16.27 46.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.982 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.31 140.86 29.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.13 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.927 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.483 0.905 0 N-CA-C 111.231 -0.334 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 73.1 mt -66.15 -18.47 65.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.24 -33.52 58.98 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.254 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.616 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 66.4 m -56.78 -50.94 85.1 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.616 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 32.9 Cg_exo -58.16 -29.4 87.25 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.904 1.736 . . . . 0.0 112.296 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.02 -47.52 68.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.95 -42.43 94.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.91 -30.98 72.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.966 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.8 -44.14 64.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.021 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.0 mtt -65.8 -33.91 76.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.738 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.62 -42.3 95.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.579 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -58.66 -44.54 90.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.379 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.7 -37.38 86.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.235 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -66.44 -30.29 70.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.603 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -74.25 -32.28 62.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.665 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -76.24 -39.59 54.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -70.22 -31.91 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.08 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -71.49 -37.95 71.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.855 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.49 -40.72 85.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -49.2 74.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.806 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.0 pt-20 -64.44 -39.73 94.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.748 0.308 . . . . 0.0 111.729 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.553 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 12.5 m120 -63.2 -53.66 49.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.949 0.404 . . . . 0.0 110.695 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.3 mt -49.05 -56.06 10.18 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.45 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.5 m -53.09 -45.96 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' N ' HG23 ' A' ' 25' ' ' VAL . 27.8 m -74.4 -35.98 40.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.146 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 91.2 mt -66.99 -23.08 65.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.049 0.452 . . . . 0.0 109.906 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 47.8 t30 -69.25 -31.02 69.28 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.06 -31.6 64.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.214 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.59 74.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.411 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 59.4 m -65.22 -42.18 93.71 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.241 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.4 p -62.46 -39.65 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.6 -43.69 97.12 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.393 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.448 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.27 -49.57 76.29 Favored Glycine 0 C--N 1.332 0.331 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.576 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.05 -21.68 66.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.047 -0.576 . . . . 0.0 110.279 178.383 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -74.59 -32.67 62.44 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.572 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.89 59.63 Favored Glycine 0 N--CA 1.433 -1.511 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.747 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.3 tt -77.45 -36.35 23.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.492 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.906 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.72 -38.75 58.29 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.906 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.9 -38.35 79.55 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -178.793 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.656 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.3 m-85 -77.84 -34.69 51.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.516 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -56.67 -47.23 80.26 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.933 0.873 . . . . 0.0 108.843 176.413 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 88.3 t -70.16 -54.21 19.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.816 -1.083 . . . . 0.0 112.266 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -76.88 -54.38 6.67 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.959 1.837 . . . . 0.0 115.959 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.02 -45.63 56.62 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 113.951 -1.477 . . . . 0.0 114.48 -175.44 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.473 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 24.9 t -55.95 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.477 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 49.73 -147.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.512 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.46 12.62 10.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.824 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -91.05 -29.6 17.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.892 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.01 -22.31 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.518 -179.098 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.7 pt -66.81 -29.7 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -54.83 -35.93 64.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.38 31.72 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.078 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.2 ttm180 -122.87 98.85 6.09 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.714 0.769 . . . . 0.0 110.208 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 58' ' ' GLY . 72.9 mt -75.19 -20.0 59.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.724 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.628 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.44 -54.49 0.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.412 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.628 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 75.4 Cg_exo -52.02 -45.44 38.83 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.562 1.508 . . . . 0.0 111.972 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -48.02 46.03 Favored Glycine 0 CA--C 1.504 -0.595 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.4 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -36.94 85.76 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.967 -0.617 . . . . 0.0 111.444 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.66 -35.07 79.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.177 0.513 . . . . 0.0 109.968 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.558 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.76 -48.98 33.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.086 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.914 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.3 t80 -71.27 -55.42 8.09 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.89 -23.96 48.57 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.692 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.09 -30.56 46.18 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.174 -1.012 . . . . 0.0 111.658 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.44 HG22 HD23 ' A' ' 70' ' ' LEU . 1.7 p -90.26 -29.94 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.394 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.684 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.93 -52.44 46.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.153 179.058 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.1 Cg_endo -64.61 -40.06 24.82 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 123.053 2.502 . . . . 0.0 112.441 -178.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -56.71 18.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.533 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 66' ' ' VAL . 4.5 mm? -58.61 -53.27 60.2 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.622 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.4 mt -49.48 -51.8 33.59 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 65.2 tp -58.28 -45.58 87.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.542 HD22 ' HB2' ' A' ' 81' ' ' TYR . 51.4 mt -69.87 -38.05 76.29 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.48 -20.0 37.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.093 0.473 . . . . 0.0 110.426 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.37 -7.24 42.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.767 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.55 HD12 ' HD2' ' A' ' 77' ' ' PRO . 15.8 tp -102.04 134.99 19.76 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.131 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.55 ' HD2' HD12 ' A' ' 76' ' ' LEU . 90.8 Cg_exo -44.81 145.35 2.93 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.573 2.182 . . . . 0.0 112.499 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.496 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 47.8 Cg_exo -55.66 -47.11 27.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.488 2.125 . . . . 0.0 112.843 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -65.05 -25.19 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.938 0.399 . . . . 0.0 111.011 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.53 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.76 -48.74 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.363 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.542 ' HB2' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -73.88 -25.82 60.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.835 0.35 . . . . 0.0 110.782 -179.393 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.83 -49.25 40.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.78 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.51 -17.73 64.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.937 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -76.28 -26.26 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.116 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.3 140.07 44.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.339 -0.839 . . . . 0.0 110.891 -179.919 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 111.114 -0.379 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.33 -18.85 62.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.781 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.17 -33.7 58.97 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.267 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.461 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 43.3 t -52.29 -51.19 74.52 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 5' ' ' SER . 51.6 Cg_endo -69.62 -28.96 25.27 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.964 1.776 . . . . 0.0 112.444 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.72 -53.52 46.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -64.08 -41.69 97.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.996 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.14 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.32 68.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.384 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.0 mtp -68.33 -30.13 69.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.35 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.09 -46.75 70.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.338 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.34 -37.61 83.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.883 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -68.51 -44.69 74.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.57 -43.47 98.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.757 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.64 -28.67 69.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.452 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -74.93 -41.73 59.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.641 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -67.83 -34.61 77.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.72 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.16 -33.58 74.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -69.11 -54.26 15.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.025 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.32 -40.89 68.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.681 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.2 pt-20 -71.77 -32.49 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.779 0.323 . . . . 0.0 111.163 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 84.2 m-20 -66.96 -54.49 21.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.945 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.0 mt -53.46 -51.28 63.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.7 m -52.77 -46.11 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.73 -37.15 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.849 0.357 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 97.0 mt -66.96 -22.67 65.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.017 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.54 -29.86 68.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.743 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.56 -33.16 64.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.366 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -42.79 75.1 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.5 t -65.49 -40.61 93.26 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.088 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.25 -40.67 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.57 96.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.271 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.85 -49.6 74.23 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.48 -19.63 65.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.045 -0.577 . . . . 0.0 110.509 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -77.74 -31.65 52.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.3 -32.14 58.43 Favored Glycine 0 N--CA 1.432 -1.573 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.41 178.417 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.9 tt -78.05 -36.09 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.393 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.799 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.37 -35.92 54.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.799 ' N ' HD12 ' A' ' 39' ' ' LEU . 56.4 p -71.38 -35.17 70.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.189 0.519 . . . . 0.0 110.5 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 18.1 m-30 -79.49 -35.36 40.31 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.279 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -55.86 -46.72 78.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.765 0.793 . . . . 0.0 108.924 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' N ' ' A' ' 44' ' ' PHE . 35.0 m -72.42 -46.16 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.243 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.8 m-85 -76.59 -53.91 7.4 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.716 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 9.3 m-85 -77.84 -48.7 15.86 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.493 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -54.44 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.233 -174.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.79 -145.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 8.31 9.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.941 0.401 . . . . 0.0 110.496 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.9 m95 -91.28 -26.76 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.596 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -63.8 -34.12 77.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.568 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.4 pt -56.49 -26.97 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -52.48 -48.73 65.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.235 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 173.15 49.76 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.073 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.566 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.8 ptt180 -156.21 102.02 2.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.535 0.683 . . . . 0.0 111.856 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' A' ' 56' ' ' ALA . 38.7 mt -73.91 -18.23 60.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.207 178.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.23 -53.79 0.17 Allowed Pre-proline 0 N--CA 1.463 0.224 0 O-C-N 123.691 0.619 . . . . 0.0 112.388 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.716 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 83.7 Cg_exo -47.61 -51.12 10.22 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.271 1.314 . . . . 0.0 111.87 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.62 -50.0 26.08 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 115.858 -0.61 . . . . 0.0 113.694 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.83 96.37 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.191 -0.504 . . . . 0.0 111.847 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -60.42 -34.08 73.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -75.03 -51.62 13.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.523 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.32 79.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.589 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.705 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.3 t80 -71.29 -55.28 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.533 -178.807 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.71 -23.82 49.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.27 -29.78 44.0 Favored Glycine 0 N--CA 1.454 -0.142 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.616 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.29 -30.29 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.216 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.69 -51.29 61.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.314 179.208 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 48.2 Cg_endo -64.94 -39.75 23.57 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 122.814 2.343 . . . . 0.0 111.992 -178.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 tm? -57.56 -57.51 12.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.123 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 4.4 mm? -57.09 -52.03 66.92 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.432 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.03 -50.96 45.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.425 HD13 ' C ' ' A' ' 72' ' ' LEU . 3.2 tm? -58.28 -45.57 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.533 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 69' ' ' LEU . 10.8 mp -71.34 -37.88 71.68 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -81.48 -23.58 37.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.01 0.433 . . . . 0.0 110.263 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.0 -6.04 56.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.336 0.589 . . . . 0.0 109.613 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.685 HD12 ' HD2' ' A' ' 77' ' ' PRO . 15.8 tp -101.73 133.07 20.99 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.003 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.685 ' HD2' HD12 ' A' ' 76' ' ' LEU . 69.7 Cg_exo -41.54 142.74 1.11 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.55 2.166 . . . . 0.0 112.582 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.488 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 51.1 Cg_exo -53.8 -48.57 21.08 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.53 2.154 . . . . 0.0 113.09 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.54 -25.14 67.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.926 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.497 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.67 -47.83 24.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -75.12 -25.45 58.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.807 0.337 . . . . 0.0 110.621 -179.61 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.2 -47.25 65.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.715 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.51 -18.03 64.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.769 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.3 -23.08 40.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.854 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.3 137.09 54.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.921 -179.847 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.483 0.901 0 N-CA-C 111.124 -0.375 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 85.3 mt -70.9 -18.65 62.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.994 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.9 -33.61 59.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.973 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.506 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 45.7 t -55.97 -51.1 83.21 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 5' ' ' SER . 35.0 Cg_endo -65.0 -33.47 51.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 121.971 1.781 . . . . 0.0 112.609 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.42 -43.27 86.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.017 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -70.93 -40.31 72.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.992 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.8 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.368 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.78 -34.76 69.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.173 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.3 tpp -67.62 -41.24 84.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.42 -32.09 73.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.133 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -66.55 -48.1 70.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.909 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.71 -44.13 96.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.797 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.06 -32.83 74.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . 0.444 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.5 t70 -68.24 -37.64 81.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.459 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.86 -31.06 59.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.97 -43.85 70.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' NZ ' ' HA ' ' A' ' 16' ' ' ASP . 9.2 ptpp? -65.55 -32.91 74.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.748 0.309 . . . . 0.0 111.021 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.38 -51.26 54.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.68 -47.1 77.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.902 -179.733 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.6 pt-20 -66.55 -37.16 84.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.749 0.309 . . . . 0.0 111.671 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 5.8 m-20 -65.22 -43.52 91.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.237 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.56 -54.89 39.95 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -52.39 -45.41 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.537 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -74.51 -38.18 45.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 120.679 0.276 . . . . 0.0 110.806 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.537 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -63.66 -24.54 67.83 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.35 -32.57 73.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.725 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.59 -32.12 67.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.354 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -45.12 69.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.46 0.648 . . . . 0.0 109.367 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.452 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 58.1 m -64.43 -39.44 93.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.31 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.725 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.89 -41.68 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.052 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.59 -43.48 93.67 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.437 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -61.49 -49.53 76.1 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.94 -21.84 66.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.429 178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.488 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.4 m-70 -76.29 -31.97 58.52 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.65 -32.58 59.23 Favored Glycine 0 N--CA 1.434 -1.461 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.898 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' HA ' ' A' ' 35' ' ' ALA . 15.1 tt -78.44 -36.51 20.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.363 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.03 -35.73 59.39 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.816 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.1 p -69.78 -40.49 76.01 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.963 0.411 . . . . 0.0 110.881 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -76.53 -33.45 58.58 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.803 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.58 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.5 -46.89 83.23 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.943 0.878 . . . . 0.0 108.852 176.305 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.9 t -70.27 -54.35 19.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.112 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -76.25 -54.45 6.78 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.859 1.799 . . . . 0.0 115.859 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -45.56 49.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.833 -1.53 . . . . 0.0 114.458 -175.361 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.63 -81.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.402 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 46.8 -147.33 0.17 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -117.64 10.63 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.963 0.411 . . . . 0.0 110.263 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -91.05 -24.99 19.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.306 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -68.97 -32.96 72.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.291 -179.128 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 pt -63.29 -28.03 44.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 110.618 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -53.84 -52.15 61.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.025 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.76 44.28 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.112 -1.042 . . . . 0.0 113.275 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.487 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 7.4 ptp180 -151.67 99.1 2.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.719 0.771 . . . . 0.0 111.45 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -72.48 -18.01 61.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.212 179.37 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.37 -52.77 0.17 Allowed Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -178.47 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.574 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 83.1 Cg_exo -48.76 -44.56 31.05 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.372 1.381 . . . . 0.0 112.173 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -47.75 47.35 Favored Glycine 0 CA--C 1.504 -0.597 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.274 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.31 90.6 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.846 -0.677 . . . . 0.0 111.308 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.79 -34.16 76.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.275 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.58 ' CE1' HD12 ' A' ' 42' ' ' LEU . 2.5 m-85 -75.31 -44.35 45.94 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.007 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.66 -39.19 88.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.628 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.3 -54.7 9.94 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.71 -23.94 49.34 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.726 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.36 42.74 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 119.957 -1.116 . . . . 0.0 111.648 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.87 -26.11 5.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.653 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.55 -51.32 70.64 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.663 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 37.9 Cg_endo -63.19 -41.31 28.23 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 123.209 2.606 . . . . 0.0 112.256 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.464 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.4 tm? -56.68 -56.8 16.79 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.32 -52.41 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.699 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.9 mt -49.65 -52.99 26.94 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.548 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 31.4 tp -56.77 -45.34 82.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.1 mp -71.01 -38.6 72.64 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.46 -22.88 37.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.039 0.447 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.499 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.18 -8.02 46.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.997 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.548 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.4 tp -78.95 146.2 67.57 Favored Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.47 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.536 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 54.5 Cg_exo -52.77 160.01 4.39 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.051 1.834 . . . . 0.0 111.365 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.415 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 50.8 Cg_exo -54.19 -57.38 1.86 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.018 1.812 . . . . 0.0 113.199 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -62.83 -26.25 68.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.836 0.35 . . . . 0.0 111.213 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.85 -45.87 33.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.794 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.415 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.5 OUTLIER -78.18 -24.3 47.25 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.669 -179.029 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.25 -43.83 63.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.403 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.95 -15.6 63.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.92 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.73 -11.84 54.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.928 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.67 141.73 34.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.116 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.06 -179.902 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.485 0.984 0 N-CA-C 111.188 -0.351 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.447 ' C ' ' HD2' ' A' ' 6' ' ' PRO . 3.7 mm? -70.75 -17.58 62.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.13 -33.42 65.08 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.353 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.642 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 42.8 t -61.15 -51.38 79.01 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 117.067 0.433 . . . . 0.0 111.879 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 31.9 Cg_exo -59.58 -30.16 91.67 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.906 1.738 . . . . 0.0 111.56 178.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.52 -33.74 76.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.452 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -75.6 -35.98 60.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.602 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -30.54 63.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.69 -46.22 47.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.8 ptm -63.84 -31.8 73.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.82 -36.08 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -67.0 -34.31 77.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.576 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -70.09 -46.54 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -66.24 -33.96 76.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.947 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.49 -48.48 64.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.0 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.61 -35.2 80.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -69.72 -39.38 76.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.258 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -68.37 -37.01 80.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.081 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.53 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.71 -53.14 45.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.078 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -48.57 70.39 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.692 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.6 pt-20 -63.92 -31.26 72.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.944 0.402 . . . . 0.0 110.996 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.448 ' O ' HD13 ' A' ' 27' ' ' LEU . 89.2 m-20 -67.64 -42.6 82.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.14 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -61.63 -50.91 70.65 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.0 m -54.75 -41.74 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.917 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.79 -41.8 47.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.746 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.511 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.6 OUTLIER -64.63 -20.6 66.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.372 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -70.89 -37.03 72.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.728 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.16 -32.4 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.801 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -45.6 68.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.232 0.539 . . . . 0.0 109.581 177.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.445 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 96.1 p -64.14 -38.2 90.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.2 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.728 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.61 -41.36 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.7 -42.81 93.84 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.425 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 64' ' ' TYR . . . -61.94 -49.38 76.13 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 178.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.605 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.03 -20.7 66.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.063 -0.569 . . . . 0.0 110.281 178.256 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.6 m-70 -75.76 -31.75 59.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.12 -32.61 58.24 Favored Glycine 0 N--CA 1.434 -1.494 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.62 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.7 tt -77.86 -36.72 22.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.318 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.83 -37.78 58.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.15 -38.28 78.7 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.922 0.391 . . . . 0.0 111.187 -178.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.681 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.4 m-85 -77.9 -33.61 51.84 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.418 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.1 mp -57.27 -47.37 81.62 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.8 t -70.16 -54.06 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.234 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -76.23 -54.12 7.25 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.496 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.84 -40.22 61.16 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 113.98 -1.464 . . . . 0.0 114.817 -175.197 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.429 ' SG ' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -67.95 9.28 0.31 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.282 0.492 . . . . 0.0 112.192 -178.549 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.504 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -43.92 153.52 0.13 Allowed 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 178.851 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.34 6.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 47' ' ' ALA . 26.4 m95 -90.78 -23.11 20.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.723 0.297 . . . . 0.0 110.899 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.416 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.04 -22.41 64.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.176 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.5 pt -70.1 -29.41 39.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 0.0 110.99 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -54.74 -33.68 61.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.874 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.58 29.39 0.03 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.519 -0.848 . . . . 0.0 113.307 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.418 ' O ' ' CG ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -124.28 97.65 5.42 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.711 0.767 . . . . 0.0 110.583 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 58' ' ' GLY . 36.1 mt -74.56 -19.23 60.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.135 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.57 -53.63 0.18 Allowed Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -178.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.8 Cg_exo -48.77 -46.43 24.53 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.417 1.411 . . . . 0.0 111.987 178.706 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.35 -48.0 42.03 Favored Glycine 0 CA--C 1.506 -0.508 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.528 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.22 93.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.923 -0.638 . . . . 0.0 111.31 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.681 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.49 -34.91 77.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.131 0.491 . . . . 0.0 109.976 179.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.583 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.0 m-85 -73.89 -42.84 60.11 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.767 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.95 85.52 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.796 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.49 -55.1 8.54 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.817 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.6 m-85 -77.86 -24.22 48.63 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.98 -31.01 44.78 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.948 -1.12 . . . . 0.0 111.609 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.02 -27.88 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.115 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -49.39 -51.16 60.38 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.974 178.477 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.817 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.9 Cg_endo -64.4 -40.43 24.66 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 123.053 2.502 . . . . 0.0 112.232 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -57.6 -55.52 33.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.58 -53.6 54.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.161 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -49.68 -52.53 30.35 Favored 'General case' 0 C--O 1.223 -0.31 0 O-C-N 123.403 0.439 . . . . 0.0 112.091 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 62.6 tp -57.39 -44.53 84.57 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.0 mp -71.42 -39.74 70.89 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.33 -23.97 37.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.379 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.511 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -90.48 -7.36 53.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.722 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.557 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.8 tp -77.98 144.8 68.55 Favored Pre-proline 0 C--O 1.231 0.117 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.355 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.51 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 57.7 Cg_exo -52.52 156.14 8.99 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.117 1.878 . . . . 0.0 111.091 178.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.416 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 50.8 Cg_exo -51.7 -58.25 1.71 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.081 1.854 . . . . 0.0 113.276 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.58 -24.97 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.793 0.33 . . . . 0.0 111.187 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.53 -45.2 31.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.765 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.6 OUTLIER -78.43 -25.26 45.96 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.521 -179.071 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.19 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -88.4 -10.74 48.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.956 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.2 154.26 22.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.093 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.92 -179.916 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.879 0 N-CA-C 111.19 -0.35 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.486 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 76.9 mt -71.42 -22.21 61.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.099 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.84 -33.79 57.15 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.25 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 68.6 m -53.23 -51.26 76.99 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 39.9 Cg_exo -57.3 -34.52 98.0 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.952 1.768 . . . . 0.0 112.274 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.56 -34.61 78.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.765 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -75.94 -40.44 54.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.12 83.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.13 64.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 47.3 ttm -72.13 -43.48 64.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.981 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -63.87 -37.87 88.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -59.94 -50.86 72.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.746 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -59.46 -38.18 80.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.699 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -66.32 -39.79 89.51 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.058 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -66.06 -41.96 90.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -70.67 -32.78 70.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.73 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.526 ' HA ' HD23 ' A' ' 21' ' ' LEU . 24.1 t70 -68.5 -40.29 80.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.431 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -68.48 -28.86 67.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.443 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -53.18 36.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.328 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 25' ' ' VAL . 1.5 pp -59.31 -42.56 91.65 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.198 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.638 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -67.36 -42.98 82.58 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.357 -176.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.572 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.4 m-20 -63.14 -54.9 30.56 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.383 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.8 tp -51.95 -52.18 52.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 21' ' ' LEU . 74.8 t -50.12 -49.85 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.1 t -72.57 -40.36 62.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.14 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 92.6 mt -63.68 -21.82 66.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.396 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.68 -31.08 67.85 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.89 -34.44 69.17 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.267 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.68 79.35 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -66.54 -39.89 88.81 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.157 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -65.57 -39.77 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.038 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.06 96.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.166 178.768 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.78 -49.24 78.09 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.64 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.3 -23.07 66.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.255 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.492 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.8 m-70 -75.27 -31.97 60.91 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.584 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.83 -33.57 60.02 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.999 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.64 HG22 ' HA ' ' A' ' 35' ' ' ALA . 16.8 tt -78.52 -36.55 20.23 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.452 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.83 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.09 -35.85 59.18 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.83 ' N ' HD12 ' A' ' 39' ' ' LEU . 35.5 p -69.54 -39.69 77.33 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.014 0.435 . . . . 0.0 110.957 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.93 -32.33 51.53 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.3 -47.11 82.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.063 0.935 . . . . 0.0 108.565 176.22 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 39' ' ' LEU . 99.4 t -70.05 -54.35 19.29 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.727 0 CA-C-N 114.691 -1.14 . . . . 0.0 112.074 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -77.2 -54.76 6.1 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.499 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -72.1 -38.29 69.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.839 -1.528 . . . . 0.0 114.374 -175.317 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.481 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.9 t -69.54 15.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.025 0.375 . . . . 0.0 111.886 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.508 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.85 156.13 0.77 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.62 7.43 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.508 ' H ' ' C ' ' A' ' 47' ' ' ALA . 29.4 m95 -90.55 -23.99 20.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.899 0.381 . . . . 0.0 110.742 178.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -68.11 -25.14 65.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.392 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 48' ' ' ALA . 39.7 pt -71.33 -29.43 35.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.662 0.267 . . . . 0.0 111.246 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -55.86 -35.75 66.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.818 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.58 32.28 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.101 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -128.43 98.08 4.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.724 0.773 . . . . 0.0 110.653 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 3.8 pp -75.28 -19.14 59.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.937 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.35 -54.29 0.17 Allowed Pre-proline 0 N--CA 1.467 0.381 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.6 Cg_exo -48.43 -45.23 27.5 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.321 1.347 . . . . 0.0 111.749 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.93 -48.49 45.21 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 115.752 -0.658 . . . . 0.0 113.276 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.13 -36.14 83.06 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.587 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.11 -35.57 81.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.189 0.519 . . . . 0.0 110.071 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.59 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.9 m-85 -72.82 -49.0 33.05 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.997 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.22 90.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.692 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.1 t80 -70.97 -55.26 8.72 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.788 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.7 -24.19 49.28 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.11 -30.49 46.4 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.639 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.432 HG22 HD13 ' A' ' 70' ' ' LEU . 1.8 p -90.16 -29.65 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.137 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.692 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.28 -51.87 53.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.247 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.5 Cg_endo -64.89 -40.2 22.19 Favored 'Trans proline' 0 N--CA 1.448 -1.166 0 C-N-CA 123.015 2.476 . . . . 0.0 112.323 -178.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.08 -54.63 44.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 0.0 110.545 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 HG22 ' A' ' 66' ' ' VAL . 11.1 mp -57.37 -53.66 55.59 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.368 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.1 mt -50.64 -49.33 57.2 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.251 0.344 . . . . 0.0 111.8 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 45.9 tp -60.05 -43.21 95.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.7 mt -71.91 -38.55 69.89 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -82.16 -21.41 36.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.985 0.421 . . . . 0.0 110.311 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.13 -3.88 55.06 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.373 0.606 . . . . 0.0 109.779 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 1.5 tp -85.97 148.14 47.33 Favored Pre-proline 0 CA--C 1.528 0.099 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.964 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.535 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.3 Cg_exo -54.19 159.14 8.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 121.937 1.758 . . . . 0.0 111.273 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.468 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 17.4 Cg_endo -57.38 -57.17 1.36 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.004 1.803 . . . . 0.0 112.97 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -62.48 -26.7 68.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.108 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.92 -45.98 32.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.925 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.6 OUTLIER -76.98 -25.41 52.73 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.905 -178.868 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.89 -47.8 57.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.694 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.91 -13.73 62.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.148 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.47 -16.76 41.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.083 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.15 143.55 26.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.216 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 65.7 p . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.773 179.858 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.483 0.887 0 N-CA-C 111.091 -0.388 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.3 mm? -71.35 -18.71 62.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.118 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.85 -33.69 59.85 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.206 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.505 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 53.1 m -56.79 -50.85 85.63 Favored Pre-proline 0 CA--C 1.537 0.453 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 5' ' ' SER . 31.5 Cg_endo -65.1 -28.22 56.93 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.034 1.823 . . . . 0.0 112.686 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.03 -57.61 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.363 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -65.88 -31.41 72.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.276 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.94 -46.14 68.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.203 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.87 -37.15 86.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -67.16 -28.59 68.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.6 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -67.42 -40.2 85.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -65.04 -31.75 73.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -50.68 39.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.835 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.15 -28.94 69.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.02 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.56 -48.65 54.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.03 -34.51 76.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.097 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -67.79 -46.56 71.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.168 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.38 -38.25 88.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.563 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -64.81 -50.67 65.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.154 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.0 -48.78 70.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.635 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.438 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.5 pt-20 -65.04 -31.23 72.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.49 ' O ' HD13 ' A' ' 27' ' ' LEU . 10.0 m120 -65.78 -46.38 78.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.339 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -60.94 -52.44 65.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.7 m -53.57 -42.6 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.254 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.28 -41.76 43.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.382 . . . . 0.0 110.915 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.7 OUTLIER -64.25 -21.93 66.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.4 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -70.07 -30.66 67.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.718 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.59 -34.4 62.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.66 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.19 -42.73 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.281 0.562 . . . . 0.0 109.525 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.0 t -65.39 -41.43 93.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -62.54 -41.09 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.086 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.97 -42.06 97.59 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.136 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.27 -50.17 67.53 Favored Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.606 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.23 -20.1 65.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.113 -0.543 . . . . 0.0 110.184 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.476 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.3 m-70 -76.48 -32.27 58.25 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.61 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.32 -33.09 59.3 Favored Glycine 0 N--CA 1.43 -1.7 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.429 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.606 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.2 tt -77.08 -37.2 25.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.468 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.845 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.82 -37.24 59.27 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.845 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -72.71 -33.43 66.44 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.919 0.39 . . . . 0.0 110.853 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 14.7 m-85 -79.7 -35.06 39.61 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.822 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.26 -45.83 79.89 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.747 0.784 . . . . 0.0 108.923 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.8 m -72.59 -45.47 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.168 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -76.15 -54.0 7.46 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.208 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.709 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 8.7 m-85 -78.68 -49.08 13.77 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.507 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -57.07 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.516 -0.874 . . . . 0.0 111.562 -175.41 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' CYS . . . 38.27 -139.51 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.88 18.75 10.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.956 0.408 . . . . 0.0 110.561 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -90.37 -37.15 14.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.824 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.442 ' CB ' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.17 -15.24 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.069 -179.484 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -58.62 -28.87 37.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.865 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -54.45 -29.96 51.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.821 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.73 26.08 0.3 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.479 -0.867 . . . . 0.0 113.357 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER -110.97 105.74 14.62 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.263 0.554 . . . . 0.0 110.244 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 56' ' ' ALA . 50.8 mt -74.31 -18.87 60.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.16 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.47 -52.17 0.17 Allowed Pre-proline 0 N--CA 1.468 0.428 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.709 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 88.1 Cg_exo -49.88 -49.67 15.39 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 121.728 1.618 . . . . 0.0 112.055 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.41 -49.36 26.25 Favored Glycine 0 CA--C 1.506 -0.503 0 CA-C-N 115.943 -0.572 . . . . 0.0 114.014 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.32 99.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.171 -0.515 . . . . 0.0 111.734 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.5 -34.84 73.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.24 0.543 . . . . 0.0 110.164 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.652 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -74.39 -44.36 52.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.169 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.17 86.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.673 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.1 m-85 -71.4 -54.77 9.61 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.827 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -77.73 -24.19 49.16 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.62 -31.42 45.21 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.605 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 p -91.8 -24.69 5.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.82 -50.53 77.28 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.714 178.297 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.827 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.0 Cg_endo -63.62 -39.75 33.62 Favored 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.923 2.415 . . . . 0.0 111.882 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 73' ' ' LEU . 10.0 tt -57.41 -58.15 9.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.185 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 10.8 mp -55.29 -52.84 62.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.451 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.7 mt -49.78 -52.54 31.18 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.327 0.392 . . . . 0.0 112.041 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 46.9 tp -56.83 -45.41 82.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.717 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.5 mm? -70.47 -38.98 74.51 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.02 -20.9 37.44 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.049 0.452 . . . . 0.0 110.452 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.572 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -93.55 -12.07 30.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.588 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 2.4 tp -73.42 150.6 89.4 Favored Pre-proline 0 N--CA 1.456 -0.164 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.322 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.588 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.9 Cg_exo -52.91 160.71 3.84 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.009 1.806 . . . . 0.0 111.206 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.42 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 25.5 Cg_endo -61.74 -56.24 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 121.884 1.723 . . . . 0.0 112.793 -179.585 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -63.95 -26.05 68.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 111.109 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.78 -47.19 26.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.691 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.42 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -76.7 -24.93 53.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.691 -179.035 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.2 -42.95 65.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.29 -18.24 64.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.765 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.53 -22.2 44.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.884 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.36 131.54 41.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.189 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.2 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.934 179.979 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.483 0.906 0 N-CA-C 111.15 -0.365 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 6.7 mp -71.15 -17.95 62.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.812 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.93 -33.96 59.37 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.973 -0.632 . . . . 0.0 113.491 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.605 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 69.3 m -55.87 -51.14 82.81 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 51.9 Cg_exo -56.15 -34.93 94.41 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.053 1.836 . . . . 0.0 112.374 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.22 -44.4 95.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.82 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -67.6 -31.37 71.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.91 -38.41 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.156 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.41 -41.75 84.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.028 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 95.6 mmm -66.05 -34.28 77.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -62.67 -37.84 88.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -65.6 -36.04 82.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -69.71 -48.02 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.999 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -66.13 -32.22 73.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.968 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.71 -49.49 52.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.57 -34.11 77.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.69 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.554 ' HA ' HD23 ' A' ' 21' ' ' LEU . 21.9 t70 -64.45 -49.86 69.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.56 -28.61 69.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.783 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.11 -56.68 8.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.555 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.681 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.2 pp -54.93 -43.97 73.81 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.508 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.681 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 12.8 pt-20 -67.35 -34.01 76.44 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -177.188 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.622 ' O ' HD13 ' A' ' 27' ' ' LEU . 10.5 m120 -67.71 -54.79 16.56 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.96 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.8 mt -53.52 -49.95 66.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 21' ' ' LEU . 19.6 m -53.68 -42.04 49.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -177.426 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 HD12 ' A' ' 27' ' ' LEU . 7.2 p -82.02 -39.13 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.425 0.155 . . . . 0.0 111.369 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.622 HD13 ' O ' ' A' ' 23' ' ' ASN . 10.4 mp -61.69 -27.86 69.0 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.77 -38.11 82.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.925 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -68.5 -31.91 71.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.739 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.69 -42.38 74.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.342 0.592 . . . . 0.0 109.7 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.432 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 34.0 t -67.42 -36.64 81.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.315 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -67.82 -44.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.075 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.434 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.86 -44.1 97.47 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.838 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.416 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.92 -49.62 73.79 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.314 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.589 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.72 -20.29 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.276 -0.462 . . . . 0.0 110.208 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.6 m-70 -76.12 -32.24 59.06 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.579 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -33.05 58.71 Favored Glycine 0 N--CA 1.435 -1.425 0 CA-C-N 114.265 -1.334 . . . . 0.0 110.854 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.5 tt -77.4 -37.44 25.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.383 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.58 -38.1 59.4 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.268 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.2 -37.78 78.29 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 120.804 0.335 . . . . 0.0 110.982 -178.812 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.639 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -78.21 -32.69 50.02 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.515 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -58.1 -46.79 84.93 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 176.262 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.4 t -69.93 -53.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.047 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -76.11 -54.91 6.13 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.521 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.78 -45.42 43.79 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.828 -1.533 . . . . 0.0 114.48 -175.236 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.511 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.46 -81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.122 0.419 . . . . 0.0 111.615 -178.638 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 50.35 -146.39 0.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.497 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.03 9.08 9.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.092 0.472 . . . . 0.0 110.616 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -91.13 -26.53 19.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.208 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.453 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.1 p90 -67.74 -23.39 65.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.455 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 48' ' ' ALA . 32.3 pt -70.66 -28.5 34.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.884 0.373 . . . . 0.0 110.702 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 52' ' ' LYS . 5.3 ttpm? -54.08 -29.55 44.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.913 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.26 37.53 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.594 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -133.96 97.79 3.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.817 0.818 . . . . 0.0 110.731 -179.954 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.61 -19.78 58.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.452 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.626 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.31 -54.68 0.2 Allowed Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 71.0 Cg_exo -50.43 -43.38 44.72 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 121.645 1.563 . . . . 0.0 112.037 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.47 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.8 -46.3 48.6 Favored Glycine 0 CA--C 1.507 -0.467 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.364 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.23 86.11 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.519 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.88 -31.07 71.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.568 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.8 m-30 -77.15 -45.23 27.48 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.926 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.93 -38.95 87.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.716 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 18.6 t80 -71.18 -55.04 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.9 -23.34 48.72 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.54 -28.99 50.48 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 119.867 -1.159 . . . . 0.0 111.652 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -91.66 -30.12 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.32 -49.84 68.26 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.992 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.1 Cg_endo -64.83 -39.09 27.07 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.93 2.42 . . . . 0.0 112.01 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.14 -54.81 42.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.52 -50.8 70.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.767 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 30' ' ' ALA . 72.0 mt -51.0 -51.09 56.49 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.351 0.407 . . . . 0.0 111.977 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 8.8 tt -59.99 -40.4 89.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.684 0.278 . . . . 0.0 111.487 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.2 tp -73.62 -40.52 63.73 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 pp -80.14 -28.47 38.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.594 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.506 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.34 -3.1 58.93 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.263 0.554 . . . . 0.0 109.518 178.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.59 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.4 tp -78.82 145.19 65.78 Favored Pre-proline 0 C--O 1.232 0.168 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.092 179.35 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.571 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 54.5 Cg_exo -51.91 155.99 7.65 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 121.829 1.686 . . . . 0.0 110.858 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.413 ' HA ' ' CD1' ' A' ' 81' ' ' TYR . 46.0 Cg_exo -55.06 -58.13 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 121.888 1.725 . . . . 0.0 113.066 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -62.64 -27.28 69.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.917 0.389 . . . . 0.0 111.238 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.19 -45.77 31.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.976 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.495 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.688 -178.8 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.53 65.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.385 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.91 -16.72 63.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -81.85 -15.99 52.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.934 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.73 137.17 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.135 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 53.3 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.295 -0.859 . . . . 0.0 110.911 -179.947 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.869 0 N-CA-C 111.209 -0.343 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.444 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 71.3 mt -71.6 -18.71 62.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.235 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.84 -33.61 59.96 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.466 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.586 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 71.0 m -60.58 -50.42 85.54 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 27.3 Cg_exo -62.47 -50.09 4.94 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.125 1.884 . . . . 0.0 113.12 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.19 -38.1 82.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.702 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -75.09 -39.26 60.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.767 0.317 . . . . 0.0 111.163 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.87 -41.38 95.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.4 -37.1 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.831 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.0 ttm -68.0 -34.18 76.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.94 -41.7 97.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.62 -36.34 78.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.315 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -69.41 -40.82 77.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.839 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -66.43 -46.64 75.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.192 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.14 -27.61 68.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.236 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.32 -43.2 33.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.941 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.47 -33.52 74.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -69.47 -38.29 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.26 -53.98 36.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.822 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -49.25 68.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.8 pt-20 -64.35 -31.53 72.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 0.0 111.057 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.586 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -66.43 -54.1 28.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.167 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 1.0 OUTLIER -53.58 -50.08 66.37 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.422 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.5 m -53.83 -44.98 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.28 -37.25 31.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.125 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 93.0 mt -66.83 -20.41 65.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.102 0.477 . . . . 0.0 109.889 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -70.79 -31.21 67.9 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.739 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.78 66.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.251 178.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.48 -41.53 76.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.8 t -66.25 -40.53 90.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.083 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -63.39 -38.79 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.39 96.85 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.31 178.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.475 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.73 71.57 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.607 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.96 -20.71 65.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.133 -0.533 . . . . 0.0 110.164 178.217 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.5 m-70 -74.94 -33.3 61.93 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.618 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.81 -33.3 60.32 Favored Glycine 0 N--CA 1.431 -1.673 0 CA-C-N 113.98 -1.464 . . . . 0.0 110.393 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.1 tt -78.05 -35.59 20.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.695 -179.744 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.855 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.8 -37.57 55.54 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.855 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -73.06 -33.24 65.55 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.851 0.358 . . . . 0.0 111.024 -179.107 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.5 m-30 -79.48 -35.39 40.3 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.927 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -56.36 -46.18 80.12 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.04 -46.11 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.1 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.5 m-85 -76.52 -54.37 6.8 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.702 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 11.1 m-85 -77.31 -48.78 16.49 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -176.184 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.501 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 49.0 t -56.05 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.763 -175.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 42.63 -143.42 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.96 12.83 9.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.549 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.618 ' HB3' HH21 ' A' ' 54' ' ' ARG . 25.8 m95 -90.66 -32.44 16.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.584 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -63.96 -11.7 30.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.818 0.342 . . . . 0.0 111.313 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.6 pt -65.25 -27.59 42.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.658 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 53' ' ' GLY . 22.2 ptmt -52.67 -43.26 65.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.179 -178.892 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.402 ' N ' ' HG3' ' A' ' 52' ' ' LYS . . . 157.43 38.74 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.254 -0.974 . . . . 0.0 112.997 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.618 HH21 ' HB3' ' A' ' 49' ' ' TRP . 16.0 ptt180 -132.29 102.4 5.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.508 0.671 . . . . 0.0 111.492 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 58' ' ' GLY . 35.0 mt -73.32 -17.48 61.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.048 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.606 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.98 -52.55 0.16 Allowed Pre-proline 0 N--CA 1.465 0.302 0 O-C-N 123.768 0.667 . . . . 0.0 112.52 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.702 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.8 Cg_exo -48.25 -51.16 10.59 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.35 1.367 . . . . 0.0 111.798 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.82 -49.17 29.1 Favored Glycine 0 CA--C 1.509 -0.34 0 CA-C-N 115.978 -0.556 . . . . 0.0 113.896 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.09 99.7 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.063 -0.568 . . . . 0.0 111.776 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.625 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.78 -35.22 74.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.279 0.562 . . . . 0.0 110.219 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.643 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.3 m-30 -73.45 -45.79 52.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.119 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.54 -38.32 89.29 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.8 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.675 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 10.5 m-85 -71.39 -54.49 10.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.69 -24.02 49.4 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.99 -31.67 42.52 Favored Glycine 0 CA--C 1.516 0.147 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.481 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -89.93 -27.44 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.139 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.675 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.28 -51.75 60.41 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.95 178.795 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.7 Cg_endo -62.37 -42.95 25.05 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 123.157 2.571 . . . . 0.0 112.143 -178.5 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.6 tm? -57.17 -55.31 36.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 88.2 mt -57.89 -55.3 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.399 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 72' ' ' LEU . 4.3 pp -55.16 -38.35 68.16 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.655 ' N ' HD12 ' A' ' 71' ' ' LEU . 47.6 tp -66.83 -44.42 81.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.688 0.28 . . . . 0.0 111.057 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.8 mp -70.97 -36.65 72.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -82.53 -23.82 34.37 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.113 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.42 -5.82 57.08 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.56 HD12 ' HD2' ' A' ' 77' ' ' PRO . 19.2 tp -108.02 135.01 19.92 Favored Pre-proline 0 C--O 1.232 0.177 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.919 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.56 ' HD2' HD12 ' A' ' 76' ' ' LEU . 83.4 Cg_exo -45.12 141.21 6.81 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.305 2.003 . . . . 0.0 112.083 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.465 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 53.1 Cg_exo -55.12 -41.76 75.46 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.477 2.118 . . . . 0.0 112.721 -179.365 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -67.48 -26.81 66.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.012 0.434 . . . . 0.0 110.418 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.516 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.07 -50.35 16.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.626 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.465 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -72.74 -24.01 60.91 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-O 120.767 0.317 . . . . 0.0 111.019 -179.553 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.82 -49.94 40.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.876 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.69 -15.28 63.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.112 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.78 -14.89 46.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.081 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.26 162.35 19.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.995 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 53.2 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.973 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.482 0.852 0 N-CA-C 111.207 -0.343 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.95 -21.55 62.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.76 -34.0 59.84 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.193 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.48 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 48.2 t -54.58 -51.01 82.19 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 5' ' ' SER . 39.6 Cg_endo -67.35 -28.91 39.01 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.921 1.747 . . . . 0.0 112.805 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.1 -50.97 62.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.32 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -71.04 -31.16 67.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.67 -40.16 76.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.372 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.87 72.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.176 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.58 -40.32 88.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -62.16 -32.12 72.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.776 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -67.48 -39.95 85.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.568 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -67.34 -40.61 85.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.644 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.41 -40.79 89.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -64.12 -40.62 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.396 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.89 -34.58 75.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.443 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 21' ' ' LEU . 16.2 t70 -67.18 -40.92 86.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.558 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HB2' ' HZ2' ' A' ' 19' ' ' LYS . 10.5 mtmp? -66.74 -28.89 68.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.429 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.09 -56.62 9.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.187 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . 0.674 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.7 pp -55.51 -39.89 71.07 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 120.835 0.35 . . . . 0.0 110.978 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.605 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -69.38 -40.89 77.15 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.453 -176.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.613 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 m-20 -65.7 -55.28 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.476 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 7.3 mt -52.41 -51.6 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.051 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 21' ' ' LEU . 26.7 m -52.53 -44.55 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.215 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.4 t -76.34 -40.97 35.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.687 0.279 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 86.0 mt -63.9 -21.35 66.42 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.021 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 24.1 t30 -69.5 -32.96 72.16 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.698 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.33 -31.8 65.98 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.41 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.78 -44.0 71.02 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 38.6 t -65.05 -40.12 94.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.247 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.698 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.05 -40.59 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.08 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.74 98.86 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.681 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' HA2' ' HD2' ' A' ' 64' ' ' TYR . . . -62.16 -49.6 73.34 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.601 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.4 -20.15 65.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.277 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.5 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 m-70 -76.57 -32.11 57.95 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -32.57 59.29 Favored Glycine 0 N--CA 1.434 -1.483 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.653 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.0 tt -77.68 -36.74 23.2 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.388 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.84 -37.62 58.84 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.88 -36.54 75.53 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 120.842 0.353 . . . . 0.0 111.061 -178.802 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.605 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.9 m-85 -79.53 -33.33 42.06 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.296 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 46' ' ' CYS . 1.1 mp -57.65 -47.34 82.53 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.759 0.79 . . . . 0.0 108.986 176.689 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 44' ' ' PHE . 30.1 m -72.49 -50.8 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.329 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' PHE . . . . . 0.469 ' N ' HG23 ' A' ' 43' ' ' VAL . 36.7 t80 -77.08 -54.25 6.77 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -177.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.02 -45.91 46.84 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 113.967 -1.469 . . . . 0.0 114.195 -175.666 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.8 t -60.04 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.197 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.72 -142.17 0.47 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.23 11.37 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.037 0.446 . . . . 0.0 110.564 178.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -90.92 -28.21 18.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.032 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 1.2 p90 -67.23 -24.64 65.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.4 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 20.2 pt -66.37 -27.45 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 0.0 110.61 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -53.52 -52.35 59.91 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.12 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 169.8 40.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.179 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.487 ' HG2' ' HA ' ' A' ' 50' ' ' TYR . 19.8 ptp180 -144.18 101.46 3.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.595 0.712 . . . . 0.0 111.425 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -73.25 -17.96 61.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.094 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.24 -54.05 0.17 Allowed Pre-proline 0 N--CA 1.468 0.433 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.1 Cg_exo -47.84 -46.41 21.61 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.321 1.348 . . . . 0.0 111.774 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.39 -46.67 44.81 Favored Glycine 0 CA--C 1.507 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.496 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.8 94.92 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.939 -0.631 . . . . 0.0 111.542 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.605 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -63.14 -34.82 78.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.962 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.592 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.85 -44.53 61.27 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.656 179.07 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.9 88.45 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.857 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 5.7 m-85 -71.22 -54.96 9.15 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -178.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.76 -24.23 49.03 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.654 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.09 43.63 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.017 -1.087 . . . . 0.0 111.64 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.58 -26.78 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.84 -52.38 57.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.007 178.775 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.9 Cg_endo -64.76 -40.66 21.26 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 123.02 2.48 . . . . 0.0 112.501 -177.877 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER -57.59 -55.65 32.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.199 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.6 -53.93 51.87 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.313 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.5 mt -49.99 -51.67 39.92 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.353 0.408 . . . . 0.0 111.839 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LEU . 65.1 tp -58.36 -46.83 85.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.32 -38.11 81.24 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.91 -21.91 37.1 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.126 0.489 . . . . 0.0 110.122 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.55 -5.76 51.01 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.596 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.461 HD12 ' HD2' ' A' ' 77' ' ' PRO . 21.3 tp -116.76 138.17 24.36 Favored Pre-proline 0 CA--C 1.53 0.185 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.186 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.461 ' HD2' HD12 ' A' ' 76' ' ' LEU . 54.2 Cg_exo -53.38 134.63 58.05 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.891 1.727 . . . . 0.0 111.465 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.06 -34.43 67.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.635 2.224 . . . . 0.0 112.579 -179.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 79' ' ' ARG . 7.6 tpm_? -67.45 -29.46 68.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.407 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.432 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -73.19 -54.53 8.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.191 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -64.48 -31.02 72.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.89 84.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.665 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.53 -15.78 63.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.98 -18.03 51.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.812 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.46 130.91 38.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.85 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.009 -179.87 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.896 0 N-CA-C 111.192 -0.349 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.505 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 2.5 pt? -66.93 -18.56 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.031 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.74 -33.67 57.59 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.124 -0.56 . . . . 0.0 113.358 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.603 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 45.5 t -52.58 -50.83 78.32 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 51.6 Cg_exo -55.52 -31.82 80.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.166 1.911 . . . . 0.0 112.743 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -63.16 -39.19 93.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -75.25 -42.0 56.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.68 96.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.35 77.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.012 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.3 ttp -68.59 -32.65 72.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.55 -36.92 79.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.828 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -65.35 -42.85 92.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -62.21 -48.73 78.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -65.34 -30.38 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.994 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -70.98 -33.72 70.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -79.28 -37.1 38.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -67.37 -36.78 82.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.753 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.17 -36.93 75.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.958 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.567 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.12 -52.24 56.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.992 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -48.88 69.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.548 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.4 pt-20 -65.29 -30.74 71.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.774 0.321 . . . . 0.0 111.085 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.431 ' O ' HD13 ' A' ' 27' ' ' LEU . 8.2 m120 -65.45 -47.9 74.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.033 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 6.2 mt -58.36 -52.47 65.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.034 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.1 m -52.62 -45.63 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.403 ' N ' HG23 ' A' ' 25' ' ' VAL . 40.8 t -73.92 -44.75 50.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.878 0.37 . . . . 0.0 110.889 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.9 OUTLIER -61.24 -21.6 64.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.337 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -70.03 -32.69 70.97 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.714 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.83 -33.41 68.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.52 -0.763 . . . . 0.0 109.431 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.42 -41.3 76.55 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.43 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.5 t -66.14 -38.73 88.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.141 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -66.65 -40.03 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -42.46 97.36 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.306 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.423 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.54 -49.12 76.5 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.643 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.05 -22.24 66.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.984 -0.608 . . . . 0.0 110.023 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.475 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 m-70 -74.47 -33.14 62.8 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.583 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.16 -34.31 61.44 Favored Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 179.004 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.643 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.2 tt -78.05 -35.94 20.97 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.206 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.565 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.905 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.51 -38.61 59.33 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.905 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.45 -39.15 81.57 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.803 0.335 . . . . 0.0 111.2 -178.848 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 10.7 m-85 -77.37 -32.82 55.19 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.606 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.655 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.77 -46.75 84.12 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.413 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.96 -54.18 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.028 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -76.13 -54.35 6.96 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 -177.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.505 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.37 -38.24 60.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 113.959 -1.473 . . . . 0.0 114.501 -175.449 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.34 16.35 0.08 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.12 0.418 . . . . 0.0 111.904 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.97 156.73 0.71 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.53 7.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.9 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TRP . . . . . 0.509 ' H ' ' C ' ' A' ' 47' ' ' ALA . 25.1 m95 -90.65 -24.43 20.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.679 0.276 . . . . 0.0 110.854 178.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -27.67 67.15 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.177 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 48' ' ' ALA . 44.4 pt -68.19 -28.9 42.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.741 0.305 . . . . 0.0 110.809 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -54.37 -34.98 62.29 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.677 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.85 30.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.408 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -127.11 98.85 5.46 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.752 0.787 . . . . 0.0 110.442 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.2 mm? -75.01 -18.89 60.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.778 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.25 -53.82 0.17 Allowed Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 87.0 Cg_exo -48.35 -44.88 28.24 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.639 1.559 . . . . 0.0 112.109 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.59 -47.61 44.82 Favored Glycine 0 CA--C 1.505 -0.555 0 CA-C-N 115.798 -0.637 . . . . 0.0 113.408 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.42 83.98 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.94 -0.63 . . . . 0.0 111.53 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.01 -32.73 74.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.162 0.506 . . . . 0.0 110.054 178.944 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.655 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.6 m-85 -76.15 -46.49 28.38 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.195 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.57 85.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.584 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.5 t80 -71.26 -55.65 7.65 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -78.15 -23.56 47.69 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.674 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.82 -30.21 48.77 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.605 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -91.27 -29.68 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.657 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.52 -50.82 56.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.929 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 39.0 Cg_endo -64.47 -39.77 27.13 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 123.02 2.48 . . . . 0.0 112.126 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tt -57.67 -54.8 42.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.69 -52.73 64.24 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.469 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.54 -50.86 52.24 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 49.9 tp -57.06 -44.73 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.614 0.245 . . . . 0.0 111.497 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 mt -71.29 -38.32 71.8 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pp -82.5 -19.69 38.25 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 110.438 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.489 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -94.86 -8.58 36.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.3 tp -78.55 145.29 67.13 Favored Pre-proline 0 C--O 1.231 0.111 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.55 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.488 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 Cg_exo -54.85 153.9 23.26 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 121.97 1.78 . . . . 0.0 111.24 178.958 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.47 -57.09 2.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.164 1.909 . . . . 0.0 113.368 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -62.56 -26.25 68.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.24 -46.81 31.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.837 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -77.58 -24.88 49.63 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.777 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.71 -44.89 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.545 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.24 -16.44 63.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.967 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.3 54.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.907 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -96.51 175.18 6.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.954 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.025 -179.933 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 111.008 -0.42 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 39.7 tp -71.54 -18.77 62.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.871 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.3 -34.71 57.49 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.42 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' SER . . . . . 0.603 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 41.6 t -56.03 -50.85 84.98 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 32.3 Cg_exo -58.57 -29.16 88.19 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.015 1.81 . . . . 0.0 112.534 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.22 -58.09 6.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.172 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -60.89 -43.73 98.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.94 -42.55 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.975 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.37 96.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.99 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.7 mtp -63.77 -31.64 72.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.774 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.45 -39.7 92.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -64.23 -48.2 76.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.292 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -58.8 -49.27 78.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.14 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -60.91 -33.84 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.17 -35.95 76.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -73.73 -34.83 64.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.984 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.54 -43.14 70.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.894 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -64.35 -32.06 73.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.163 0.506 . . . . 0.0 110.287 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -66.78 -53.32 34.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.874 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -47.37 72.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.793 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLU . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.2 pt-20 -64.45 -31.37 72.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.923 0.392 . . . . 0.0 111.027 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ASN . . . . . 0.625 ' O ' HD13 ' A' ' 27' ' ' LEU . 6.4 m-20 -66.75 -53.14 36.33 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.771 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt -50.06 -52.16 36.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 22' ' ' GLU . 29.6 m -55.29 -40.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' VAL . . . . . 0.613 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -80.11 -40.66 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.353 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -61.89 -27.14 68.59 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.15 -39.09 82.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.375 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -69.08 -33.82 74.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.247 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.45 -43.85 72.44 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.2 t -65.28 -36.93 85.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.429 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.7 OUTLIER -67.87 -43.3 86.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.987 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.419 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.73 -43.42 97.91 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.915 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.04 -49.8 71.65 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.447 -0.882 . . . . 0.0 111.206 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.51 -21.26 66.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.085 -0.557 . . . . 0.0 110.215 178.294 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.469 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 m-70 -75.73 -32.7 60.14 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.65 59.84 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.959 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.6 tt -77.75 -36.86 23.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.52 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.68 -37.19 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -70.32 -38.57 74.96 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 120.865 0.364 . . . . 0.0 111.061 -178.92 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -77.42 -33.56 54.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.54 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.548 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.17 -47.2 81.79 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.308 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.5 t -70.01 -54.2 20.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.138 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -76.42 -54.37 6.83 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.92 -45.71 48.86 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.484 -175.232 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' CYS . . . . . 0.523 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 31.6 t -59.27 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.463 -178.842 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.49 -142.39 0.44 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.11 9.08 9.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.948 0.404 . . . . 0.0 110.625 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -90.52 -25.19 20.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.1 p90 -66.08 -26.69 67.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.216 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.43 -28.6 41.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.841 0.353 . . . . 0.0 110.671 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -54.46 -52.34 62.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.143 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.6 42.22 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.31 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.482 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 9.8 ptp180 -147.75 96.28 2.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.635 0.731 . . . . 0.0 111.546 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.512 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -71.41 -18.02 62.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.793 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.547 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.36 -52.41 0.17 Allowed Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PRO . . . . . 0.58 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -47.63 -45.18 24.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 121.284 1.323 . . . . 0.0 111.944 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -48.89 44.24 Favored Glycine 0 CA--C 1.505 -0.551 0 CA-C-N 115.941 -0.572 . . . . 0.0 113.523 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.68 88.23 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.938 -0.631 . . . . 0.0 111.373 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.2 -33.97 77.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.212 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' TYR . . . . . 0.58 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.7 m-85 -74.53 -43.21 56.9 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.812 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.2 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.023 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.0 m-85 -71.13 -54.77 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -77.85 -23.6 48.86 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.58 -29.49 48.33 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 119.888 -1.148 . . . . 0.0 111.617 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.01 -28.5 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.7 -50.44 73.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 114.944 -1.026 . . . . 0.0 111.048 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.6 Cg_endo -65.18 -38.93 25.34 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.082 2.522 . . . . 0.0 112.171 -178.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 1.7 tm? -57.55 -56.49 21.18 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.64 -50.73 71.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.085 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.494 HD13 ' HB1' ' A' ' 30' ' ' ALA . 63.6 mt -49.82 -53.43 25.48 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.556 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.7 tt -57.21 -42.99 82.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.542 0.21 . . . . 0.0 111.482 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.6 mm? -72.02 -38.2 69.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.809 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.65 -20.74 35.68 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.406 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ALA . . . . . 0.56 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -93.25 -4.74 51.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 109.464 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.3 tp -78.88 144.14 63.46 Favored Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.103 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.527 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 62.6 Cg_exo -50.89 152.2 10.29 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 121.883 1.722 . . . . 0.0 111.118 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PRO . . . . . 0.419 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 64.6 Cg_exo -50.23 -60.3 0.88 Allowed 'Trans proline' 0 CA--C 1.528 0.197 0 C-N-CA 122.185 1.923 . . . . 0.0 113.528 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -63.12 -25.23 68.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.259 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.59 -44.37 34.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.864 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' TYR . . . . . 0.453 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.6 OUTLIER -78.72 -25.22 44.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.518 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.59 71.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.162 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.6 -20.71 64.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.815 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -75.04 -20.74 59.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.994 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -81.22 121.79 26.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.962 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.338 -0.839 . . . . 0.0 111.027 -179.851 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_exo . . . . . 0 C--O 1.231 0.166 0 CA-C-O 120.752 0.23 . . . . 0.0 112.186 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.95 -38.28 90.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.682 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.96 -31.73 68.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.567 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.24 -40.97 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.217 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.22 83.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.263 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -68.25 -38.66 82.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -60.76 -41.76 96.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.034 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -63.34 -30.54 71.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.802 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -70.24 -47.94 59.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.55 -31.26 72.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -72.09 -32.48 67.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -75.85 -40.93 53.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -68.19 -41.95 80.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.876 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HD3' ' O ' ' A' ' 19' ' ' LYS . 6.8 tmtm? -63.51 -37.0 85.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.637 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.77 -53.0 46.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.155 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.498 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.38 -46.6 73.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.877 -179.084 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.552 ' HG3' HD22 ' A' ' 23' ' ' ASN . 12.3 pt-20 -65.68 -32.47 74.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.741 0.305 . . . . 0.0 111.399 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.661 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -67.07 -54.49 20.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.746 0.308 . . . . 0.0 111.256 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.7 mt -50.72 -52.02 44.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' GLU . 32.7 m -54.84 -42.75 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.6 t -77.01 -51.64 18.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.61 0.243 . . . . 0.0 111.48 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -53.51 -35.13 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -62.38 -38.01 87.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.307 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.686 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -67.34 -32.57 73.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.763 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.466 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.68 -41.27 75.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.304 0.573 . . . . 0.0 109.508 177.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.1 t -67.39 -36.91 82.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.359 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -68.25 -43.63 84.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.96 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.429 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -61.32 -42.87 99.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.91 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.413 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -63.15 -49.67 69.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.117 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.565 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.53 -20.66 66.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.102 178.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.8 m-70 -75.79 -31.9 59.66 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.58 -33.47 58.24 Favored Glycine 0 N--CA 1.435 -1.393 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.097 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.9 tt -78.25 -35.99 20.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.45 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.18 -36.49 58.66 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -70.97 -38.26 72.76 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 120.798 0.332 . . . . 0.0 111.015 -178.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.69 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.48 -33.5 54.51 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.471 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.694 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -57.93 -46.47 84.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.971 0.891 . . . . 0.0 108.698 176.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 39' ' ' LEU . 89.0 t -70.42 -53.26 23.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.093 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -76.21 -54.39 6.87 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.82 -45.7 34.49 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 113.886 -1.507 . . . . 0.0 114.556 -175.266 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 16.1 t -54.9 -80.85 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.054 0.388 . . . . 0.0 111.356 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 51.16 -147.98 0.38 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.447 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.3 7.87 9.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.928 0.394 . . . . 0.0 110.865 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -90.97 -25.39 19.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.191 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.27 -26.29 64.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.563 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 48' ' ' ALA . 38.9 pt -68.9 -29.48 43.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.823 0.344 . . . . 0.0 111.055 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -55.08 -39.16 68.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.839 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 162.33 34.06 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.881 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.2 ttm180 -129.12 95.98 4.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.876 0.846 . . . . 0.0 110.569 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 58' ' ' GLY . 44.8 mt -75.64 -20.11 58.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.726 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.48 -54.82 0.2 Allowed Pre-proline 0 N--CA 1.47 0.542 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.5 Cg_exo -48.74 -42.9 35.95 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.696 1.597 . . . . 0.0 112.056 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.76 -49.24 41.77 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.42 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.52 -38.91 91.81 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.896 -0.652 . . . . 0.0 111.262 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.69 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.91 -35.56 80.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.343 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.694 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.7 m-85 -73.57 -43.13 60.58 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.826 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.9 -39.31 83.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.013 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -70.76 -54.85 10.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -78.12 -23.28 47.9 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.22 -29.87 48.47 Favored Glycine 0 CA--C 1.518 0.263 0 C-N-CA 119.736 -1.221 . . . . 0.0 111.521 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.27 -27.21 4.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.667 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.17 -49.95 78.43 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.913 178.534 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.8 Cg_endo -65.78 -38.05 25.35 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.161 2.574 . . . . 0.0 112.071 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.74 -55.13 39.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -56.24 -51.12 69.28 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.783 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.466 HD13 ' HB1' ' A' ' 30' ' ' ALA . 77.5 mt -51.21 -49.41 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.387 0.429 . . . . 0.0 111.667 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.655 HD12 HD23 ' A' ' 27' ' ' LEU . 31.0 tp -57.12 -45.76 83.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.712 0.291 . . . . 0.0 111.229 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.25 -38.61 71.91 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -81.59 -23.62 36.97 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.733 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.632 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -91.42 -0.38 57.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.41 0.624 . . . . 0.0 109.377 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.459 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 18.9 tp . . . . . 0 CA--C 1.531 0.244 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.366 179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo . . . . . 0 C--O 1.231 0.162 0 N-CA-C 112.658 0.214 . . . . 0.0 112.658 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.43 -49.61 70.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -67.23 -42.45 83.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.218 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.21 -36.75 80.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.13 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.7 -37.09 67.94 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.3 tpp -65.91 -34.88 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -66.0 -35.79 81.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -64.64 -41.99 95.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.695 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -64.95 -48.73 73.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.108 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -63.49 -33.29 75.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.422 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.07 -33.91 65.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.066 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -73.79 -40.76 63.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.965 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.98 -35.32 76.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.948 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -66.0 -40.71 91.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.76 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.586 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.31 -48.12 74.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.62 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -49.52 69.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.44 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.64 -31.46 71.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.366 . . . . 0.0 110.723 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.626 ' O ' HD13 ' A' ' 27' ' ' LEU . 26.8 t-20 -61.42 -53.86 51.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.968 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.8 mt -55.55 -39.88 71.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.799 0.333 . . . . 0.0 110.672 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.74 -46.12 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.909 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.4 t -73.6 -41.05 55.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.538 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.1 mp -58.6 -27.6 64.81 Favored 'General case' 0 CA--C 1.522 -0.102 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.81 -32.57 71.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.218 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.32 -36.05 63.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.884 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.49 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.09 -40.41 78.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.3 t -67.66 -39.42 84.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.276 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.6 -41.59 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.08 97.3 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.457 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.31 -49.97 69.29 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.183 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.603 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.96 -20.18 65.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.32 -0.44 . . . . 0.0 110.262 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.8 m-70 -75.77 -31.68 59.61 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.639 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.61 -31.5 56.28 Favored Glycine 0 N--CA 1.433 -1.564 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.511 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.688 ' O ' HD13 ' A' ' 42' ' ' LEU . 13.9 tt -78.43 -35.11 18.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.215 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.807 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.94 -35.79 50.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.896 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.807 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.8 p -71.52 -37.96 71.14 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.072 0.463 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.647 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.6 m-85 -75.56 -35.9 60.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.483 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.2 mp -56.89 -43.71 81.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 39' ' ' LEU . 82.2 t -70.86 -47.79 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.751 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.47 -53.7 8.23 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -178.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.72 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 17.0 m-85 -80.98 -48.15 12.66 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.588 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.0 t -62.19 1.99 0.27 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.703 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.536 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -44.54 153.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.413 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.94 5.69 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.536 ' H ' ' C ' ' A' ' 47' ' ' ALA . 38.8 m95 -90.2 -23.49 21.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.603 0.24 . . . . 0.0 111.076 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.478 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.03 -14.09 62.83 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.865 0.364 . . . . 0.0 110.755 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 48' ' ' ALA . 14.6 pt -68.55 -26.9 34.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.511 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -52.35 -39.77 61.12 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.357 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.08 39.14 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.986 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.567 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.5 ptt180 -135.11 102.34 5.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.751 0.786 . . . . 0.0 111.619 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.533 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -73.17 -17.5 61.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.522 178.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.05 -51.86 0.15 Allowed Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.72 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.1 Cg_exo -47.82 -48.5 15.85 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.418 1.412 . . . . 0.0 112.019 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.57 -48.26 28.73 Favored Glycine 0 CA--C 1.508 -0.37 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.066 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.94 93.81 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.357 -0.421 . . . . 0.0 111.969 -178.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.647 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.47 -31.5 72.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.313 0.578 . . . . 0.0 110.175 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.656 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -78.05 -45.13 24.42 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.207 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -35.87 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.239 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.4 t80 -71.33 -55.29 8.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.328 -179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.807 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -78.33 -23.19 47.12 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.483 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -79.31 -29.39 49.99 Favored Glycine 0 CA--C 1.517 0.194 0 C-N-CA 119.994 -1.098 . . . . 0.0 111.29 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.82 -28.46 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.29 -49.91 73.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.669 178.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.4 Cg_endo -62.75 -39.51 42.27 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.887 2.391 . . . . 0.0 111.611 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 73' ' ' LEU . 10.1 tt -57.36 -59.41 5.18 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.0 mp -51.02 -50.82 57.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.729 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 ' HB1' ' A' ' 30' ' ' ALA . 98.2 mt -52.62 -45.6 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.275 0.36 . . . . 0.0 111.75 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.19 -44.74 95.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.341 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.4 mp -71.54 -38.58 71.04 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -80.57 -28.04 37.31 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.553 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.87 -0.04 55.78 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 39.6 tp . . . . . 0 C--O 1.231 0.117 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.91 179.362 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo . . . . . 0 N--CA 1.472 0.209 0 N-CA-C 113.082 0.378 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.25 -45.28 93.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.497 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -69.3 -37.23 77.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.185 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.92 -33.52 73.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.294 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.77 -41.48 62.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.76 -32.0 73.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.796 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.95 -37.27 83.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.745 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -64.22 -45.26 89.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.001 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -61.85 -51.09 69.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -60.45 -39.97 89.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.267 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.33 -34.74 78.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.096 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -74.3 -37.27 63.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -70.55 -32.88 70.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.981 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -72.23 -38.33 68.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.826 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.94 -50.36 56.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.96 -48.68 72.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.271 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.451 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.8 pt-20 -63.96 -33.98 76.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.622 0.248 . . . . 0.0 110.794 -179.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.564 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 7.7 m120 -58.83 -52.55 65.26 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 2.4 mt -48.17 -50.4 29.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.524 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.1 t -49.75 -53.92 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.276 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.56 -45.66 77.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 73.3 mt -61.52 -24.34 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.705 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -67.27 -30.4 70.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.84 -31.28 66.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.007 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.98 76.71 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.459 ' HB2' HD21 ' A' ' 72' ' ' LEU . 33.7 t -65.32 -43.27 91.54 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.997 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -62.28 -40.43 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.51 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.18 99.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.608 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.75 -49.54 75.12 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.612 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.81 -19.94 65.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.146 -0.527 . . . . 0.0 110.352 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.463 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.7 m-70 -76.17 -31.57 58.58 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.26 -32.0 56.37 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.531 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 35' ' ' ALA . 12.9 tt -77.67 -36.2 22.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.285 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.811 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.08 -36.29 55.92 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.811 ' N ' HD12 ' A' ' 39' ' ' LEU . 48.6 p -71.15 -36.37 72.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 110.649 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 17.0 m-85 -78.23 -35.98 47.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -55.74 -46.11 77.86 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.92 0.867 . . . . 0.0 108.709 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.8 t -70.33 -49.36 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.123 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.4 m-85 -75.98 -54.0 7.53 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.697 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 6.8 m-85 -77.18 -48.68 16.97 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 40.4 t -53.1 -81.28 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.568 -175.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 41.51 -141.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.458 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 13.11 9.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.885 0.374 . . . . 0.0 110.729 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 20.1 m95 -91.18 -26.27 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.264 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.501 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -69.02 -31.55 70.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.332 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.8 pt -61.34 -28.15 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.873 0.368 . . . . 0.0 110.436 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -54.06 -50.89 65.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.077 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.25 40.62 0.04 OUTLIER Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.035 -1.079 . . . . 0.0 113.877 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.563 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 8.0 ptm180 -148.39 105.46 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.741 0.782 . . . . 0.0 111.83 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.432 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.3 pp -74.46 -17.8 60.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.597 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.81 -51.98 0.15 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.697 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 90.7 Cg_exo -47.86 -49.17 14.26 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.331 1.354 . . . . 0.0 111.878 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -49.15 -49.68 29.98 Favored Glycine 0 CA--C 1.505 -0.564 0 CA-C-N 115.995 -0.548 . . . . 0.0 113.616 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.67 -42.42 99.61 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.017 -0.592 . . . . 0.0 111.619 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.43 -36.97 76.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.296 0.57 . . . . 0.0 110.217 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.633 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.2 m-30 -72.07 -46.49 56.67 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.025 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.8 88.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.704 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.612 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.4 m-85 -71.51 -54.18 11.41 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.82 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.66 -24.59 49.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.78 -31.54 43.97 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.54 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.26 -25.79 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.632 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.05 -51.69 59.64 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.639 178.331 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.82 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.72 -39.4 26.76 Favored 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 122.95 2.434 . . . . 0.0 112.257 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tt -58.26 -54.42 47.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.844 0.354 . . . . 0.0 110.415 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 74' ' ' LEU . 6.4 tp -58.01 -53.8 54.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.37 -52.57 27.46 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 27' ' ' LEU . 2.7 mm? -57.55 -45.08 85.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 85.5 mt -69.62 -38.45 77.23 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.538 HD23 ' HG ' ' A' ' 70' ' ' LEU . 1.7 pp -82.27 -19.97 38.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.028 0.442 . . . . 0.0 110.201 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.95 -7.17 43.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.761 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 17.2 tp . . . . . 0 CA--C 1.532 0.26 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.129 179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo . . . . . 0 C--O 1.232 0.201 0 N-CA-C 112.682 0.224 . . . . 0.0 112.682 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.59 -56.12 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.468 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -68.18 -31.38 70.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.525 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -44.27 83.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.52 -27.6 63.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.055 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.9 ttt -73.7 -38.19 64.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.12 -33.32 75.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.836 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -69.17 -37.62 78.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -69.35 -42.07 75.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.795 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -66.26 -43.86 85.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.947 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.68 -38.37 90.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.945 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -70.73 -36.65 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.828 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -70.72 -34.22 71.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.056 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -71.1 -39.44 72.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.25 -47.8 75.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -56.14 -49.64 73.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.634 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.47 -33.25 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.76 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.464 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.7 m120 -60.7 -41.09 94.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.434 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.6 mt -59.51 -48.34 82.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 110.786 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.452 HG23 ' H ' ' A' ' 25' ' ' VAL . 3.4 t -49.87 -53.58 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.371 -178.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.612 HG23 HD13 ' A' ' 27' ' ' LEU . 4.8 m -71.49 -39.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.424 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.612 HD13 HG23 ' A' ' 26' ' ' VAL . 1.5 mp -63.66 -24.24 67.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.285 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -69.53 -32.11 70.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.722 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.53 -33.9 67.19 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.725 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.47 -43.79 72.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.281 0.562 . . . . 0.0 109.623 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.423 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -64.18 -38.67 91.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.203 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.722 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.6 OUTLIER -66.26 -40.56 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.448 179.023 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.28 93.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.514 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.14 77.18 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 178.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.567 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.08 -20.47 66.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.085 -0.558 . . . . 0.0 110.109 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.471 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.3 m-70 -75.99 -32.32 59.4 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.07 -34.08 58.85 Favored Glycine 0 N--CA 1.433 -1.542 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.888 178.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 35' ' ' ALA . 17.5 tt -77.27 -37.22 25.28 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.359 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.25 -38.23 60.62 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.54 -38.57 77.53 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.252 -178.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.0 m-85 -77.68 -33.49 53.25 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.577 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.28 -47.07 82.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.919 0.866 . . . . 0.0 108.838 176.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.83 -54.41 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.169 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -76.36 -54.42 6.78 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.541 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.32 -46.0 52.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 113.877 -1.51 . . . . 0.0 114.395 -175.347 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.533 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -60.02 -81.42 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.445 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.76 -141.08 0.36 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -119.08 9.97 11.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 -90.26 -27.94 19.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.571 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.2 p90 -66.85 -40.21 87.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.824 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -28.73 45.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -54.82 -52.05 63.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.825 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.02 44.77 0.06 OUTLIER Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.375 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 17.2 ptp180 -157.68 102.44 1.87 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.696 0.76 . . . . 0.0 111.653 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 pp -73.9 -18.38 60.91 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.167 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.17 -52.99 0.17 Allowed Pre-proline 0 N--CA 1.47 0.534 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.1 Cg_exo -48.37 -42.9 33.68 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 121.486 1.457 . . . . 0.0 112.16 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -46.91 48.77 Favored Glycine 0 CA--C 1.505 -0.535 0 CA-C-N 115.905 -0.588 . . . . 0.0 113.105 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.06 89.7 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.804 -0.698 . . . . 0.0 111.447 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.62 -32.06 73.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.02 0.438 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.572 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -76.37 -49.35 17.05 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.333 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.25 93.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.836 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.5 t80 -71.15 -54.71 10.1 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.81 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.57 -23.94 49.89 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.789 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.52 -29.47 48.71 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.672 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 p -91.28 -29.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.76 -50.43 73.58 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.187 179.123 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.81 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.37 -40.46 24.75 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 C-N-CA 122.962 2.442 . . . . 0.0 112.075 -178.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.93 -54.75 43.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.382 . . . . 0.0 110.01 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.7 mt -57.97 -53.34 59.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.411 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 86.7 mt -49.58 -52.87 27.16 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.433 0.458 . . . . 0.0 112.11 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 58.8 tp -56.81 -46.21 81.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.634 0.254 . . . . 0.0 111.614 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.6 -37.96 77.11 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.62 -21.72 35.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.002 0.429 . . . . 0.0 110.243 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.529 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -91.25 -10.41 41.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.581 178.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.421 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 24.8 tp . . . . . 0 CA--C 1.533 0.304 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 179.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo . . . . . 0 C--O 1.23 0.109 0 CA-C-O 120.915 0.298 . . . . 0.0 112.008 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.06 -43.45 98.87 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.047 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -69.22 -47.75 63.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.78 -37.07 78.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.277 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.44 -32.55 64.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.453 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 44.2 ttp -69.54 -45.48 68.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.016 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.12 -31.44 71.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.755 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -66.61 -40.71 88.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.737 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . 0.408 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 24.6 ttmm -64.26 -48.0 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.706 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.35 -24.26 66.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.17 -53.18 13.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.093 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 14' ' ' LYS . 3.0 p30 -67.63 -30.81 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.978 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -68.83 -45.64 70.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.014 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -64.9 -36.56 84.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -63.72 -51.3 65.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.9 -49.51 71.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.638 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.409 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.4 pt-20 -63.68 -35.07 79.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.724 0.297 . . . . 0.0 111.141 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.479 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.9 m120 -59.82 -43.76 94.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.687 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.9 mt -58.08 -48.58 79.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.03 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.4 t -49.68 -53.69 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.193 -178.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.569 HG23 HD13 ' A' ' 27' ' ' LEU . 4.3 m -72.07 -38.64 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.59 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.569 HD13 HG23 ' A' ' 26' ' ' VAL . 1.9 mp -63.96 -24.85 67.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.272 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -70.01 -30.0 67.2 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.96 -34.77 66.71 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.419 178.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.12 78.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.1 t -66.71 -38.63 87.13 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -66.52 -41.66 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.86 94.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.487 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.6 -49.54 75.66 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.607 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.36 -22.16 66.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.067 -0.567 . . . . 0.0 110.238 178.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.2 m-70 -75.6 -31.76 60.05 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.569 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.25 -33.9 58.56 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.946 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 35' ' ' ALA . 20.0 tt -77.89 -36.57 22.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.512 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.7 -37.06 59.79 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.71 -38.82 77.09 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.623 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -77.6 -32.5 53.64 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.619 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.592 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.76 -46.75 84.1 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 91.9 t -69.9 -54.16 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 114.949 -1.023 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -76.23 -54.93 6.08 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -38.15 64.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 113.679 -1.601 . . . . 0.0 114.447 -175.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.489 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 7.4 t -70.57 16.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.849 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.526 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -50.18 156.59 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.85 8.79 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.526 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.83 -25.84 19.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.659 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.22 63.53 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.616 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 48' ' ' ALA . 30.7 pt -70.03 -29.26 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.287 . . . . 0.0 111.022 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -54.71 -29.91 54.57 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 149.52 30.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 113.138 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.0 ttm180 -122.52 98.77 6.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.825 0.821 . . . . 0.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.13 -18.87 60.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.404 179.219 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.9 -54.49 0.19 Allowed Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 79.8 Cg_exo -49.09 -45.09 30.74 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.492 1.462 . . . . 0.0 112.027 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.53 -47.26 45.17 Favored Glycine 0 CA--C 1.506 -0.524 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.345 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.57 94.87 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.945 -0.627 . . . . 0.0 111.496 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.623 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.96 -35.13 79.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 0.0 110.238 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.592 ' CE1' HD12 ' A' ' 42' ' ' LEU . 3.1 m-30 -73.15 -43.81 60.99 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.863 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.7 -39.44 84.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.007 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.3 m-85 -71.01 -54.64 10.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.828 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.1 m-85 -77.76 -24.06 49.1 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.36 45.7 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.056 -1.069 . . . . 0.0 111.721 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -91.13 -27.51 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.109 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.43 -50.57 75.76 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.114 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.828 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.6 Cg_endo -64.96 -40.51 20.49 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.112 2.541 . . . . 0.0 112.155 -178.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -55.79 30.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.107 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.03 -52.61 64.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.223 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 71.7 mt -49.63 -53.64 22.98 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.362 0.414 . . . . 0.0 112.073 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.452 HD12 HD23 ' A' ' 27' ' ' LEU . 40.2 tp -57.59 -44.7 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.45 -39.67 81.38 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.3 pp -82.65 -20.15 36.86 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.214 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.496 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.15 -9.51 42.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.523 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 17.5 tp . . . . . 0 CA--C 1.532 0.271 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.114 179.478 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo . . . . . 0 C--O 1.231 0.131 0 CA-C-O 120.666 0.194 . . . . 0.0 112.568 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.31 -38.82 84.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.81 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -71.54 -35.47 70.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.85 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.91 -34.91 74.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.089 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.55 -48.85 45.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.427 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 91.6 mtp -59.89 -43.62 94.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.99 -37.22 76.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.02 -51.2 70.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -60.2 -36.71 78.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -66.34 -37.73 86.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.688 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.55 -45.13 76.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.9 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -67.93 -31.95 72.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' HD23 ' A' ' 21' ' ' LEU . 15.6 t70 -67.96 -49.54 61.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.815 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -62.57 -28.59 69.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.719 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.16 66.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.472 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.72 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.1 pp -62.4 -44.13 97.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.68 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 11.9 pt-20 -68.44 -37.58 80.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.656 HD22 ' HG3' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -66.15 -55.02 18.42 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.973 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.7 tp -52.23 -52.0 55.0 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 21' ' ' LEU . 18.8 m -52.34 -44.49 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.0 t -75.46 -41.18 42.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.796 0.332 . . . . 0.0 110.993 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 87.2 mt -63.7 -22.43 66.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.412 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -69.65 -30.39 68.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.736 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.44 -33.63 65.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.442 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.03 76.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.6 t -65.53 -41.08 93.47 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.06 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.736 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.65 -38.89 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.75 97.9 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.277 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.47 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.11 -49.65 72.93 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.47 -21.21 66.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.926 -0.637 . . . . 0.0 110.254 178.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.464 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.4 m-70 -75.59 -31.75 60.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.28 -32.95 57.51 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.861 178.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.591 ' O ' HD13 ' A' ' 42' ' ' LEU . 14.0 tt -77.92 -36.08 21.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.335 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.85 -35.97 57.12 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.989 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.808 ' N ' HD12 ' A' ' 39' ' ' LEU . 32.8 p -70.83 -38.14 73.23 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.071 0.462 . . . . 0.0 110.537 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.628 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 16.4 m-85 -76.01 -35.24 59.62 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.389 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.591 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.5 mp -56.21 -45.49 79.84 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.941 0.877 . . . . 0.0 108.763 176.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.4 t -70.98 -48.22 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.097 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.77 -53.84 7.87 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -177.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.681 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.4 m-85 -78.82 -48.71 14.24 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.485 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 29.4 t -52.5 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.029 -0.669 . . . . 0.0 111.913 -175.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 44.73 -143.16 0.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.41 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.74 12.18 9.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.976 0.417 . . . . 0.0 110.846 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.9 m95 -91.13 -28.64 17.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.208 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.519 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.26 -28.22 66.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.527 -179.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.9 pt -65.06 -28.9 45.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.329 . . . . 0.0 111.067 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -54.56 -32.01 57.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.034 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 150.57 44.88 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.608 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -141.78 100.96 3.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.644 0.735 . . . . 0.0 110.664 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.85 -20.03 58.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.249 178.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.66 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.96 -54.03 0.19 Allowed Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.681 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.6 Cg_exo -50.14 -47.89 22.08 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.694 1.596 . . . . 0.0 111.94 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.58 -48.03 29.02 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.747 -0.661 . . . . 0.0 113.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.91 -42.86 97.31 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.134 -0.533 . . . . 0.0 111.794 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.628 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.72 -34.7 73.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.304 0.573 . . . . 0.0 110.153 179.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.634 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -74.1 -46.24 44.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.969 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.98 92.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.632 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.34 -54.77 9.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.836 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.67 -24.31 49.39 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.7 -32.15 42.28 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.493 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.21 -26.11 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.12 -51.0 72.15 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.942 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.836 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.0 Cg_endo -64.44 -40.14 25.67 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 122.841 2.36 . . . . 0.0 112.132 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -57.92 -56.22 24.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.955 0.407 . . . . 0.0 110.342 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.0 mt -57.44 -54.15 50.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.426 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.4 mt -48.88 -50.95 32.46 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.395 0.434 . . . . 0.0 112.011 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.489 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 2.4 tt -59.21 -50.57 73.51 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.655 -179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 12.3 tp -64.57 -37.71 88.51 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 2.0 pp -81.6 -24.34 36.5 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.377 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.51 -7.63 52.46 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.369 0.604 . . . . 0.0 109.525 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.4 tm? . . . . . 0 CA--C 1.532 0.275 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.496 179.647 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo . . . . . 0 C--O 1.23 0.123 0 N-CA-C 112.751 0.251 . . . . 0.0 112.751 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.29 -46.6 82.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.706 0.288 . . . . 0.0 111.155 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -67.34 -36.99 82.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.08 -42.58 84.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.61 -43.41 98.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.989 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.0 ttt -62.87 -34.28 77.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.636 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.06 -42.56 99.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.984 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -63.63 -33.76 76.33 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -69.8 -52.64 23.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -61.09 -32.26 71.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.151 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.93 -31.53 68.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.857 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -77.41 -43.66 31.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.061 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.98 -34.43 78.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.283 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -68.23 -48.91 63.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.226 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.18 78.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.338 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.479 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.01 -46.46 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.546 -179.74 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.479 ' N ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -66.75 -37.11 83.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.677 0.275 . . . . 0.0 111.099 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 95.2 m-20 -63.13 -38.76 92.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.0 110.613 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.51 -53.65 55.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.454 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' LEU . 23.1 t -51.44 -48.22 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.494 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.567 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -73.32 -36.2 48.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.656 0.265 . . . . 0.0 111.074 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.567 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -65.92 -24.01 66.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.034 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.38 -30.6 68.63 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.731 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.32 -33.69 65.28 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.463 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.47 74.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.452 0.644 . . . . 0.0 109.346 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.1 m -65.23 -40.61 94.3 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.318 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.731 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -63.08 -39.62 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.5 -41.45 97.3 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.381 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.17 -49.74 71.9 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.625 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.75 -20.18 65.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.157 -0.522 . . . . 0.0 110.176 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.5 m-70 -75.72 -33.21 60.29 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.33 -32.91 59.48 Favored Glycine 0 N--CA 1.43 -1.748 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.43 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.642 ' O ' HD13 ' A' ' 42' ' ' LEU . 12.4 tt -77.46 -36.63 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.527 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.865 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.93 -38.85 57.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.865 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -71.19 -36.17 71.83 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.981 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 13.1 m-85 -76.1 -35.93 59.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.121 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.642 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.8 mp -56.05 -44.83 79.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.1 t -70.91 -48.28 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.941 -1.027 . . . . 0.0 112.048 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -53.77 8.12 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.742 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.8 m-85 -79.23 -47.72 15.46 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -176.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.545 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.2 t -60.78 -0.53 0.29 Allowed 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.549 -175.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.521 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -46.9 161.18 0.07 Allowed 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -62.77 10.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.521 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.29 -26.3 20.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.778 0.323 . . . . 0.0 110.532 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -69.48 -33.1 72.38 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.219 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.6 pt -59.56 -27.7 38.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.899 0.38 . . . . 0.0 110.687 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -53.27 -42.39 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.087 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.89 48.62 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.053 -1.07 . . . . 0.0 113.52 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 13.4 ptp180 -154.88 107.13 2.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.741 0.782 . . . . 0.0 111.708 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.459 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 4.4 pp -74.12 -16.84 61.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.618 178.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -23.99 -51.52 0.12 Allowed Pre-proline 0 N--CA 1.467 0.384 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.742 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 82.3 Cg_exo -47.39 -49.96 12.14 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 121.379 1.386 . . . . 0.0 111.823 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -48.39 -48.07 27.84 Favored Glycine 0 CA--C 1.509 -0.307 0 CA-C-N 115.879 -0.6 . . . . 0.0 113.905 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.27 97.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.141 -0.529 . . . . 0.0 112.049 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.189 0.519 . . . . 0.0 110.126 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.648 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -75.45 -45.03 41.13 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.179 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.05 83.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.693 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 23.5 t80 -71.19 -54.54 10.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.29 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.62 -23.77 49.73 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.02 -29.19 47.39 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.614 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -90.94 -29.08 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.693 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.81 -50.44 73.83 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.978 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.6 Cg_endo -63.84 -39.57 32.89 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.933 2.422 . . . . 0.0 111.902 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.1 -58.24 9.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.918 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 mp -56.62 -51.51 68.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.32 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.2 mt -49.33 -52.64 26.64 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 47.6 tp -59.31 -44.25 92.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 11.4 tp -70.34 -39.08 74.9 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.91 -25.79 34.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.005 0.431 . . . . 0.0 110.411 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.531 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -85.79 -8.55 58.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.43 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 33.8 tp . . . . . 0 CA--C 1.534 0.329 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.777 179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.3 Cg_exo . . . . . 0 C--O 1.231 0.154 0 CA-C-O 120.708 0.212 . . . . 0.0 112.466 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -58.1 -50.35 73.78 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -64.19 -36.47 84.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -32.7 73.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.57 -36.79 60.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.082 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 85.9 mtp -70.54 -35.66 73.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.23 -35.71 81.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.789 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -67.03 -36.34 81.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.387 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -66.46 -50.23 64.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.607 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.96 -41.33 91.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.865 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -62.53 -32.62 73.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.588 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.26 -41.71 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.675 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -66.43 -31.39 72.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -72.53 -35.68 68.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.724 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.19 -48.22 68.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.433 ' O ' HG22 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -57.68 -49.5 76.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.5 -35.7 81.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.666 0.269 . . . . 0.0 111.567 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.481 ' O ' HD13 ' A' ' 27' ' ' LEU . 11.0 m120 -65.87 -42.51 90.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.787 0.327 . . . . 0.0 111.012 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.08 -55.74 30.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 21' ' ' LEU . 2.3 m -52.81 -43.91 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.295 -178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -72.1 -41.59 67.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.807 0.337 . . . . 0.0 110.946 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.515 ' HB3' HD23 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -64.67 -22.93 67.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.508 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -69.31 -34.25 74.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.713 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.16 65.71 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.723 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -44.69 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.286 0.565 . . . . 0.0 109.601 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 43.2 t -64.37 -39.6 94.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.212 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -64.5 -40.76 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.246 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.31 95.64 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.338 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.44 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.93 -49.36 76.39 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.609 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.01 -21.35 66.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.254 178.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 10.1 m-70 -75.96 -33.28 59.79 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.589 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.82 -33.42 60.17 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.924 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.609 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.9 tt -77.78 -36.77 22.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.479 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.886 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.49 -37.95 59.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.886 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.19 -38.47 78.65 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 120.75 0.309 . . . . 0.0 111.016 -178.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.559 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.0 m-85 -77.9 -32.78 51.94 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.459 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.523 HD12 ' CE1' ' A' ' 61' ' ' TYR . 0.9 OUTLIER -57.68 -46.99 83.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 122.024 0.916 . . . . 0.0 108.674 176.399 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 39' ' ' LEU . 90.6 t -70.15 -53.92 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.007 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -76.07 -54.28 7.08 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.31 -45.82 45.0 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.039 -1.437 . . . . 0.0 114.387 -175.331 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.547 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -61.09 -81.15 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.317 -179.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.97 -144.83 0.35 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.11 13.49 10.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.12 -35.3 14.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.011 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -63.2 -13.69 40.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.344 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.9 pt -67.05 -28.55 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.055 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -53.82 -29.6 41.46 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.684 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.11 30.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.749 . . . . 0.0 113.069 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.7 ttm180 -117.83 99.17 6.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.674 0.75 . . . . 0.0 110.253 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.518 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -74.71 -19.89 60.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.59 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.604 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.22 -54.21 0.19 Allowed Pre-proline 0 N--CA 1.467 0.418 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.0 Cg_exo -48.4 -45.83 25.33 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.589 1.526 . . . . 0.0 112.032 178.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.26 -47.03 43.48 Favored Glycine 0 CA--C 1.506 -0.496 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.411 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.29 95.93 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.9 -0.65 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.559 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.14 -33.38 74.37 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.108 0.48 . . . . 0.0 110.228 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.593 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-85 -75.26 -44.2 47.18 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.833 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.2 87.58 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.779 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.53 -54.65 9.85 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -77.68 -24.13 49.38 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.47 45.25 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.045 -1.074 . . . . 0.0 111.574 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.25 -26.74 5.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.35 -50.49 75.88 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.829 178.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.7 Cg_endo -64.06 -39.64 30.82 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 122.974 2.449 . . . . 0.0 111.973 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.29 -56.27 23.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.048 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -57.32 -52.81 63.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.418 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.2 mt -49.28 -52.9 24.62 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 3.2 tm? -56.59 -45.17 81.55 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.6 mt -71.14 -39.09 72.19 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.69 -21.02 38.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.969 0.414 . . . . 0.0 110.5 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.498 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -93.65 -8.99 39.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.88 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.518 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 5.1 tp . . . . . 0 C--N 1.332 -0.153 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.404 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_endo . . . . . 0 C--O 1.231 0.147 0 CA-C-O 120.664 0.193 . . . . 0.0 112.492 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.34 -53.17 61.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -66.31 -38.79 88.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.354 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.69 84.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.56 -36.93 68.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.979 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 tpp -65.81 -41.61 91.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.43 -37.73 81.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.728 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -62.31 -43.45 98.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.673 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -62.9 -55.33 26.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.015 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -57.45 -32.51 67.0 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.377 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.06 -44.07 77.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -69.45 -33.1 72.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.75 -37.27 73.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.165 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -70.95 -34.79 71.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -68.72 -52.83 26.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.442 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.23 -45.19 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.496 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.442 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.7 pt-20 -66.95 -30.98 71.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.864 0.364 . . . . 0.0 110.736 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.48 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.3 m-20 -68.0 -42.33 80.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.232 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.9 mt -62.78 -51.51 66.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.737 0.303 . . . . 0.0 111.715 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.6 m -53.2 -45.43 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.535 HG13 HD13 ' A' ' 27' ' ' LEU . 8.3 p -74.91 -37.51 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.778 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.563 HD11 ' HB1' ' A' ' 75' ' ' ALA . 1.2 mp -64.32 -22.92 67.12 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.857 -0.424 . . . . 0.0 109.857 179.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -70.39 -31.2 68.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.294 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.726 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.14 -35.31 66.47 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.46 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.83 -38.89 80.16 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 32.9 t -66.81 -40.47 88.07 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.075 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.49 -39.24 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.021 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.4 98.94 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.387 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.425 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.84 -49.3 77.25 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.619 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -65.91 -21.59 66.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.071 -0.565 . . . . 0.0 110.284 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.45 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 8.1 m-70 -73.89 -31.9 63.33 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.54 -32.5 57.53 Favored Glycine 0 N--CA 1.434 -1.437 0 CA-C-N 114.086 -1.415 . . . . 0.0 111.006 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.6 tt -78.13 -35.97 20.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.279 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.814 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.11 -35.43 56.38 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.814 ' N ' HD12 ' A' ' 39' ' ' LEU . 34.0 p -70.22 -38.59 75.28 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.023 0.44 . . . . 0.0 110.969 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.658 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.9 m-85 -78.45 -34.0 48.05 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.849 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -57.04 -47.14 81.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.009 0.909 . . . . 0.0 108.711 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.8 t -70.26 -54.39 18.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.291 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -76.4 -54.56 6.56 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.497 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.44 -37.49 65.83 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 113.956 -1.474 . . . . 0.0 114.422 -175.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.488 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.56 16.18 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.089 0.404 . . . . 0.0 111.79 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -48.69 153.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.485 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -60.17 5.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.487 ' H ' ' C ' ' A' ' 47' ' ' ALA . 55.3 m95 -90.06 -24.83 21.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -22.05 63.89 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.161 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -69.09 -29.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.217 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -54.86 -42.88 72.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.628 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 164.76 30.65 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.066 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -120.98 97.01 5.33 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.855 0.836 . . . . 0.0 110.449 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 39.4 mt -75.14 -18.91 60.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.182 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.89 -53.72 0.19 Allowed Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 81.0 Cg_exo -49.52 -45.18 32.09 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.537 1.492 . . . . 0.0 112.056 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.38 -49.78 37.42 Favored Glycine 0 CA--C 1.505 -0.59 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.474 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.12 88.81 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.871 -0.665 . . . . 0.0 111.219 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.78 -36.84 84.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.241 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.581 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.5 m-85 -72.14 -43.87 63.99 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.765 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.3 87.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.893 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.643 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -71.46 -55.01 8.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.815 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -77.81 -24.16 48.85 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.44 -31.25 46.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 119.984 -1.103 . . . . 0.0 111.68 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -91.67 -26.47 5.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.64 -50.57 71.99 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.862 178.588 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.815 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 41.6 Cg_endo -64.79 -39.83 24.43 Favored 'Trans proline' 0 N--CA 1.448 -1.167 0 C-N-CA 122.978 2.452 . . . . 0.0 112.262 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.55 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.983 0.42 . . . . 0.0 110.339 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.2 mt -58.53 -53.83 53.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.096 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.9 mt -49.58 -51.67 35.52 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.347 0.404 . . . . 0.0 112.089 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.543 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.1 tt -58.2 -43.9 87.82 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 78.5 mt -70.99 -39.12 72.64 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -81.74 -23.2 36.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 110.353 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.563 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -89.83 -7.14 55.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.474 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tp . . . . . 0 N--CA 1.456 -0.168 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.225 179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo . . . . . 0 C--O 1.231 0.136 0 CA-C-O 120.854 0.272 . . . . 0.0 112.296 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.02 -47.52 68.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.95 -42.43 94.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.91 -30.98 72.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.966 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.8 -44.14 64.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.021 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.0 mtt -65.8 -33.91 76.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.738 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.62 -42.3 95.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.579 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -58.66 -44.54 90.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.379 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.7 -37.38 86.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.235 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -66.44 -30.29 70.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.603 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -74.25 -32.28 62.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.665 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -76.24 -39.59 54.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -70.22 -31.91 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.08 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -71.49 -37.95 71.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.855 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.49 -40.72 85.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -49.2 74.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.806 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.0 pt-20 -64.44 -39.73 94.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.748 0.308 . . . . 0.0 111.729 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.553 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.4 m-20 -63.2 -53.66 49.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.949 0.404 . . . . 0.0 110.695 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.3 mt -49.05 -56.06 10.18 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.45 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.5 m -53.09 -45.96 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.41 ' N ' HG23 ' A' ' 25' ' ' VAL . 27.8 m -74.4 -35.98 40.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.146 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 91.2 mt -66.99 -23.08 65.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.049 0.452 . . . . 0.0 109.906 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.25 -31.02 69.28 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.06 -31.6 64.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.214 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.59 74.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.411 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 59.4 m -65.22 -42.18 93.71 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.241 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.4 p -62.46 -39.65 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.6 -43.69 97.12 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.393 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.448 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.27 -49.57 76.29 Favored Glycine 0 C--N 1.332 0.331 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.576 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.05 -21.68 66.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.047 -0.576 . . . . 0.0 110.279 178.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -74.59 -32.67 62.44 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.572 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.89 59.63 Favored Glycine 0 N--CA 1.433 -1.511 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.747 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.3 tt -77.45 -36.35 23.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.492 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.906 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.72 -38.75 58.29 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.906 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.9 -38.35 79.55 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -178.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.656 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.3 m-85 -77.84 -34.69 51.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.516 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -56.67 -47.23 80.26 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.933 0.873 . . . . 0.0 108.843 176.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 88.3 t -70.16 -54.21 19.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.816 -1.083 . . . . 0.0 112.266 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -76.88 -54.38 6.67 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.959 1.837 . . . . 0.0 115.959 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.02 -45.63 56.62 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 113.951 -1.477 . . . . 0.0 114.48 -175.44 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.473 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 24.9 t -55.95 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.477 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 49.73 -147.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.512 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.46 12.62 10.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.824 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -91.05 -29.6 17.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.892 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.01 -22.31 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.518 -179.098 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.7 pt -66.81 -29.7 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -54.83 -35.93 64.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.38 31.72 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.078 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.2 ttm180 -122.87 98.85 6.09 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.714 0.769 . . . . 0.0 110.208 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 58' ' ' GLY . 72.9 mt -75.19 -20.0 59.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.724 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.628 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.44 -54.49 0.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.628 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 75.4 Cg_exo -52.02 -45.44 38.83 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.562 1.508 . . . . 0.0 111.972 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -48.02 46.03 Favored Glycine 0 CA--C 1.504 -0.595 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.4 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -36.94 85.76 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.967 -0.617 . . . . 0.0 111.444 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.66 -35.07 79.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.177 0.513 . . . . 0.0 109.968 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.558 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.76 -48.98 33.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.086 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.914 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.3 t80 -71.27 -55.42 8.09 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.89 -23.96 48.57 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.692 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.09 -30.56 46.18 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.174 -1.012 . . . . 0.0 111.658 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.44 HG22 HD23 ' A' ' 70' ' ' LEU . 1.7 p -90.26 -29.94 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.684 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.93 -52.44 46.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.153 179.058 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.1 Cg_endo -64.61 -40.06 24.82 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 123.053 2.502 . . . . 0.0 112.441 -178.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -56.71 18.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.533 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 66' ' ' VAL . 4.5 mm? -58.61 -53.27 60.2 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.622 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.4 mt -49.48 -51.8 33.59 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 65.2 tp -58.28 -45.58 87.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 51.4 mt -69.87 -38.05 76.29 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.48 -20.0 37.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.093 0.473 . . . . 0.0 110.426 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.37 -7.24 42.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.767 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.406 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 15.8 tp . . . . . 0 CA--C 1.532 0.28 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.131 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_endo . . . . . 0 C--O 1.231 0.137 0 CA-C-O 120.707 0.211 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.72 -53.52 46.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -64.08 -41.69 97.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.996 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.14 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.32 68.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.384 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.0 mtp -68.33 -30.13 69.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.35 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.09 -46.75 70.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.338 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.34 -37.61 83.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.883 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -68.51 -44.69 74.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.57 -43.47 98.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.757 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.64 -28.67 69.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.452 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -74.93 -41.73 59.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.641 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -67.83 -34.61 77.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.72 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.16 -33.58 74.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -69.11 -54.26 15.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.025 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.32 -40.89 68.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.681 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.457 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.2 pt-20 -71.77 -32.49 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.779 0.323 . . . . 0.0 111.163 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 84.2 m-20 -66.96 -54.49 21.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.945 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.0 mt -53.46 -51.28 63.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.7 m -52.77 -46.11 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.73 -37.15 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.849 0.357 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 97.0 mt -66.96 -22.67 65.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.017 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.54 -29.86 68.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.743 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.56 -33.16 64.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.366 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -42.79 75.1 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.5 t -65.49 -40.61 93.26 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.088 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.25 -40.67 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.57 96.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.271 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.85 -49.6 74.23 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.48 -19.63 65.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.045 -0.577 . . . . 0.0 110.509 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -77.74 -31.65 52.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.3 -32.14 58.43 Favored Glycine 0 N--CA 1.432 -1.573 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.41 178.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.9 tt -78.05 -36.09 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.393 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.799 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.37 -35.92 54.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.799 ' N ' HD12 ' A' ' 39' ' ' LEU . 56.4 p -71.38 -35.17 70.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.189 0.519 . . . . 0.0 110.5 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 18.1 m-30 -79.49 -35.36 40.31 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.279 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -55.86 -46.72 78.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.765 0.793 . . . . 0.0 108.924 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' N ' ' A' ' 44' ' ' PHE . 35.0 m -72.42 -46.16 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.243 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.8 m-85 -76.59 -53.91 7.4 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.716 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 9.3 m-85 -77.84 -48.7 15.86 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.493 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -54.44 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.233 -174.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.79 -145.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 8.31 9.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.941 0.401 . . . . 0.0 110.496 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.9 m95 -91.28 -26.76 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.596 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -63.8 -34.12 77.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.568 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.4 pt -56.49 -26.97 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -52.48 -48.73 65.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.235 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 173.15 49.76 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.073 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.566 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.8 ptt180 -156.21 102.02 2.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.535 0.683 . . . . 0.0 111.856 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' A' ' 56' ' ' ALA . 38.7 mt -73.91 -18.23 60.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.207 178.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.23 -53.79 0.17 Allowed Pre-proline 0 N--CA 1.463 0.224 0 O-C-N 123.691 0.619 . . . . 0.0 112.388 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.716 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 83.7 Cg_exo -47.61 -51.12 10.22 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.271 1.314 . . . . 0.0 111.87 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.62 -50.0 26.08 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 115.858 -0.61 . . . . 0.0 113.694 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.83 96.37 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.191 -0.504 . . . . 0.0 111.847 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -60.42 -34.08 73.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -75.03 -51.62 13.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.523 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.32 79.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.589 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.705 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.3 t80 -71.29 -55.28 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.533 -178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.71 -23.82 49.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.27 -29.78 44.0 Favored Glycine 0 N--CA 1.454 -0.142 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.616 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.29 -30.29 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.69 -51.29 61.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.314 179.208 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 48.2 Cg_endo -64.94 -39.75 23.57 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 122.814 2.343 . . . . 0.0 111.992 -178.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 tm? -57.56 -57.51 12.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.123 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 4.4 mm? -57.09 -52.03 66.92 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.432 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.03 -50.96 45.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.425 HD13 ' C ' ' A' ' 72' ' ' LEU . 3.2 tm? -58.28 -45.57 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.533 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 69' ' ' LEU . 10.8 mp -71.34 -37.88 71.68 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -81.48 -23.58 37.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.01 0.433 . . . . 0.0 110.263 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.0 -6.04 56.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.336 0.589 . . . . 0.0 109.613 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 15.8 tp . . . . . 0 CA--C 1.53 0.174 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.003 179.338 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo . . . . . 0 CA--C 1.526 0.113 0 CA-C-O 120.74 0.225 . . . . 0.0 112.609 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.42 -43.27 86.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.017 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -70.93 -40.31 72.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.992 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.8 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.368 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.78 -34.76 69.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.173 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.3 tpp -67.62 -41.24 84.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.42 -32.09 73.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.133 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -66.55 -48.1 70.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.909 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.71 -44.13 96.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.797 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.06 -32.83 74.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . 0.444 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.5 t70 -68.24 -37.64 81.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.459 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.86 -31.06 59.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.97 -43.85 70.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.444 ' NZ ' ' HA ' ' A' ' 16' ' ' ASP . 9.2 ptpp? -65.55 -32.91 74.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.748 0.309 . . . . 0.0 111.021 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.38 -51.26 54.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.68 -47.1 77.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.902 -179.733 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.458 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.6 pt-20 -66.55 -37.16 84.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.749 0.309 . . . . 0.0 111.671 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 5.8 m-20 -65.22 -43.52 91.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.237 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.56 -54.89 39.95 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -52.39 -45.41 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.537 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -74.51 -38.18 45.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 120.679 0.276 . . . . 0.0 110.806 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.537 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -63.66 -24.54 67.83 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.35 -32.57 73.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.725 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.59 -32.12 67.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.354 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -45.12 69.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.46 0.648 . . . . 0.0 109.367 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.452 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 58.1 m -64.43 -39.44 93.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.31 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.725 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.89 -41.68 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.052 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.59 -43.48 93.67 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.437 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -61.49 -49.53 76.1 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.94 -21.84 66.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.429 178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.488 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.4 m-70 -76.29 -31.97 58.52 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.65 -32.58 59.23 Favored Glycine 0 N--CA 1.434 -1.461 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.898 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' HA ' ' A' ' 35' ' ' ALA . 15.1 tt -78.44 -36.51 20.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.363 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.03 -35.73 59.39 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.816 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.1 p -69.78 -40.49 76.01 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.963 0.411 . . . . 0.0 110.881 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -76.53 -33.45 58.58 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.803 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.58 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.5 -46.89 83.23 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.943 0.878 . . . . 0.0 108.852 176.305 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.9 t -70.27 -54.35 19.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.112 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -76.25 -54.45 6.78 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.859 1.799 . . . . 0.0 115.859 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -45.56 49.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.833 -1.53 . . . . 0.0 114.458 -175.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.63 -81.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.402 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 46.8 -147.33 0.17 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -117.64 10.63 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.963 0.411 . . . . 0.0 110.263 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -91.05 -24.99 19.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.306 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -68.97 -32.96 72.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.291 -179.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 pt -63.29 -28.03 44.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 110.618 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -53.84 -52.15 61.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.025 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.76 44.28 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.112 -1.042 . . . . 0.0 113.275 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.487 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 7.4 ptp180 -151.67 99.1 2.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.719 0.771 . . . . 0.0 111.45 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -72.48 -18.01 61.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.212 179.37 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.37 -52.77 0.17 Allowed Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -178.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.574 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 83.1 Cg_exo -48.76 -44.56 31.05 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.372 1.381 . . . . 0.0 112.173 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -47.75 47.35 Favored Glycine 0 CA--C 1.504 -0.597 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.274 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.31 90.6 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.846 -0.677 . . . . 0.0 111.308 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.79 -34.16 76.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.275 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.58 ' CE1' HD12 ' A' ' 42' ' ' LEU . 2.5 m-85 -75.31 -44.35 45.94 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.007 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.66 -39.19 88.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.628 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.3 -54.7 9.94 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.71 -23.94 49.34 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.36 42.74 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 119.957 -1.116 . . . . 0.0 111.648 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.87 -26.11 5.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.653 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.55 -51.32 70.64 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.663 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 37.9 Cg_endo -63.19 -41.31 28.23 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 123.209 2.606 . . . . 0.0 112.256 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.464 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.4 tm? -56.68 -56.8 16.79 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.32 -52.41 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.699 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.9 mt -49.65 -52.99 26.94 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.548 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 31.4 tp -56.77 -45.34 82.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.1 mp -71.01 -38.6 72.64 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.46 -22.88 37.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.039 0.447 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.499 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.18 -8.02 46.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.997 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.548 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.4 tp . . . . . 0 C--O 1.231 0.11 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.47 179.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo . . . . . 0 C--O 1.231 0.132 0 CA-C-O 120.993 0.33 . . . . 0.0 111.56 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.52 -33.74 76.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.452 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -75.6 -35.98 60.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.602 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -30.54 63.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.69 -46.22 47.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.8 ptm -63.84 -31.8 73.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.82 -36.08 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -67.0 -34.31 77.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.576 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -70.09 -46.54 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -66.24 -33.96 76.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.947 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.49 -48.48 64.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.0 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.61 -35.2 80.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -69.72 -39.38 76.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.258 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -68.37 -37.01 80.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.081 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.53 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.71 -53.14 45.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.078 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -48.57 70.39 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.692 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.6 pt-20 -63.92 -31.26 72.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.944 0.402 . . . . 0.0 110.996 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.448 ' O ' HD13 ' A' ' 27' ' ' LEU . 89.2 m-20 -67.64 -42.6 82.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.14 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -61.63 -50.91 70.65 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.0 m -54.75 -41.74 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.917 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.79 -41.8 47.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.746 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.511 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.6 OUTLIER -64.63 -20.6 66.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.372 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -70.89 -37.03 72.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.728 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.16 -32.4 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.801 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -45.6 68.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.232 0.539 . . . . 0.0 109.581 177.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.445 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 96.1 p -64.14 -38.2 90.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.2 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.728 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.61 -41.36 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.7 -42.81 93.84 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.425 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 64' ' ' TYR . . . -61.94 -49.38 76.13 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 178.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.605 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.03 -20.7 66.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.063 -0.569 . . . . 0.0 110.281 178.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.6 m-70 -75.76 -31.75 59.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.12 -32.61 58.24 Favored Glycine 0 N--CA 1.434 -1.494 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.62 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.7 tt -77.86 -36.72 22.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.318 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.83 -37.78 58.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.15 -38.28 78.7 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.922 0.391 . . . . 0.0 111.187 -178.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.681 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.4 m-85 -77.9 -33.61 51.84 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.418 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.1 mp -57.27 -47.37 81.62 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.8 t -70.16 -54.06 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.234 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -76.23 -54.12 7.25 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.496 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.84 -40.22 61.16 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 113.98 -1.464 . . . . 0.0 114.817 -175.197 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.429 ' SG ' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -67.95 9.28 0.31 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.282 0.492 . . . . 0.0 112.192 -178.549 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.504 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -43.92 153.52 0.13 Allowed 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 178.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.34 6.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 47' ' ' ALA . 26.4 m95 -90.78 -23.11 20.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.723 0.297 . . . . 0.0 110.899 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.416 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.04 -22.41 64.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.176 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.5 pt -70.1 -29.41 39.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 0.0 110.99 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -54.74 -33.68 61.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.874 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.58 29.39 0.03 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.519 -0.848 . . . . 0.0 113.307 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.418 ' O ' ' CG ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -124.28 97.65 5.42 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.711 0.767 . . . . 0.0 110.583 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 58' ' ' GLY . 36.1 mt -74.56 -19.23 60.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.135 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.57 -53.63 0.18 Allowed Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -178.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.8 Cg_exo -48.77 -46.43 24.53 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.417 1.411 . . . . 0.0 111.987 178.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.35 -48.0 42.03 Favored Glycine 0 CA--C 1.506 -0.508 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.528 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.22 93.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.923 -0.638 . . . . 0.0 111.31 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.681 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.49 -34.91 77.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.131 0.491 . . . . 0.0 109.976 179.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.583 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.0 m-85 -73.89 -42.84 60.11 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.767 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.95 85.52 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.796 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.49 -55.1 8.54 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.817 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.6 m-85 -77.86 -24.22 48.63 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.98 -31.01 44.78 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.948 -1.12 . . . . 0.0 111.609 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.02 -27.88 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.115 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -49.39 -51.16 60.38 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.974 178.477 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.817 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.9 Cg_endo -64.4 -40.43 24.66 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 123.053 2.502 . . . . 0.0 112.232 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -57.6 -55.52 33.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.58 -53.6 54.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.161 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -49.68 -52.53 30.35 Favored 'General case' 0 C--O 1.223 -0.31 0 O-C-N 123.403 0.439 . . . . 0.0 112.091 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 62.6 tp -57.39 -44.53 84.57 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.0 mp -71.42 -39.74 70.89 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.33 -23.97 37.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.379 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.511 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -90.48 -7.36 53.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.722 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.557 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.8 tp . . . . . 0 C--O 1.231 0.117 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.355 179.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.9 Cg_exo . . . . . 0 C--O 1.231 0.158 0 CA-C-O 120.815 0.256 . . . . 0.0 112.274 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.56 -34.61 78.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.765 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -75.94 -40.44 54.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.12 83.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.13 64.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 47.3 ttm -72.13 -43.48 64.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.981 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -63.87 -37.87 88.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -59.94 -50.86 72.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.746 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -59.46 -38.18 80.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.699 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -66.32 -39.79 89.51 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.058 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -66.06 -41.96 90.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -70.67 -32.78 70.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.73 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.526 ' HA ' HD23 ' A' ' 21' ' ' LEU . 24.1 t70 -68.5 -40.29 80.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.431 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -68.48 -28.86 67.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.443 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -53.18 36.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.328 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 25' ' ' VAL . 1.5 pp -59.31 -42.56 91.65 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.198 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.638 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -67.36 -42.98 82.58 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.357 -176.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.572 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.4 m-20 -63.14 -54.9 30.56 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.383 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.8 tp -51.95 -52.18 52.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 21' ' ' LEU . 74.8 t -50.12 -49.85 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.1 t -72.57 -40.36 62.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.14 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 92.6 mt -63.68 -21.82 66.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.396 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.68 -31.08 67.85 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.89 -34.44 69.17 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.267 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.68 79.35 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -66.54 -39.89 88.81 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.157 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -65.57 -39.77 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.06 96.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.166 178.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.78 -49.24 78.09 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.64 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.3 -23.07 66.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.255 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.492 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.8 m-70 -75.27 -31.97 60.91 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.584 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.83 -33.57 60.02 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.999 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.64 HG22 ' HA ' ' A' ' 35' ' ' ALA . 16.8 tt -78.52 -36.55 20.23 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.452 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.83 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.09 -35.85 59.18 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.83 ' N ' HD12 ' A' ' 39' ' ' LEU . 35.5 p -69.54 -39.69 77.33 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.014 0.435 . . . . 0.0 110.957 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.93 -32.33 51.53 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.3 -47.11 82.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.063 0.935 . . . . 0.0 108.565 176.22 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 39' ' ' LEU . 99.4 t -70.05 -54.35 19.29 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.727 0 CA-C-N 114.691 -1.14 . . . . 0.0 112.074 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -77.2 -54.76 6.1 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.499 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -72.1 -38.29 69.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.839 -1.528 . . . . 0.0 114.374 -175.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.481 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.9 t -69.54 15.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.025 0.375 . . . . 0.0 111.886 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.508 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.85 156.13 0.77 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.62 7.43 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.508 ' H ' ' C ' ' A' ' 47' ' ' ALA . 29.4 m95 -90.55 -23.99 20.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.899 0.381 . . . . 0.0 110.742 178.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -68.11 -25.14 65.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.392 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 48' ' ' ALA . 39.7 pt -71.33 -29.43 35.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.662 0.267 . . . . 0.0 111.246 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -55.86 -35.75 66.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.818 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.58 32.28 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.101 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -128.43 98.08 4.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.724 0.773 . . . . 0.0 110.653 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 3.8 pp -75.28 -19.14 59.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.937 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.35 -54.29 0.17 Allowed Pre-proline 0 N--CA 1.467 0.381 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.6 Cg_exo -48.43 -45.23 27.5 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.321 1.347 . . . . 0.0 111.749 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.93 -48.49 45.21 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 115.752 -0.658 . . . . 0.0 113.276 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.13 -36.14 83.06 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.587 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.11 -35.57 81.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.189 0.519 . . . . 0.0 110.071 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.59 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.9 m-85 -72.82 -49.0 33.05 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.997 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.22 90.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.692 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.1 t80 -70.97 -55.26 8.72 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.788 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.7 -24.19 49.28 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.11 -30.49 46.4 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.639 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.432 HG22 HD13 ' A' ' 70' ' ' LEU . 1.8 p -90.16 -29.65 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.137 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.692 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.28 -51.87 53.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.247 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.5 Cg_endo -64.89 -40.2 22.19 Favored 'Trans proline' 0 N--CA 1.448 -1.166 0 C-N-CA 123.015 2.476 . . . . 0.0 112.323 -178.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.08 -54.63 44.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 0.0 110.545 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 HG22 ' A' ' 66' ' ' VAL . 11.1 mp -57.37 -53.66 55.59 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.368 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.1 mt -50.64 -49.33 57.2 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.251 0.344 . . . . 0.0 111.8 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 45.9 tp -60.05 -43.21 95.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.7 mt -71.91 -38.55 69.89 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -82.16 -21.41 36.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.985 0.421 . . . . 0.0 110.311 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.13 -3.88 55.06 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.373 0.606 . . . . 0.0 109.779 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.524 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 1.5 tp . . . . . 0 CA--C 1.528 0.099 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.964 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_endo . . . . . 0 C--O 1.232 0.179 0 N-CA-C 112.686 0.226 . . . . 0.0 112.686 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.03 -57.61 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.363 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -65.88 -31.41 72.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.276 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.94 -46.14 68.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.203 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.87 -37.15 86.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -67.16 -28.59 68.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.6 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -67.42 -40.2 85.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -65.04 -31.75 73.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -50.68 39.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.835 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.15 -28.94 69.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.02 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.56 -48.65 54.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.03 -34.51 76.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.097 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -67.79 -46.56 71.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.168 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.38 -38.25 88.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.563 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -64.81 -50.67 65.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.154 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.0 -48.78 70.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.635 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.438 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.5 pt-20 -65.04 -31.23 72.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.49 ' O ' HD13 ' A' ' 27' ' ' LEU . 93.3 m-20 -65.78 -46.38 78.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.339 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -60.94 -52.44 65.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.7 m -53.57 -42.6 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.254 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.28 -41.76 43.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.382 . . . . 0.0 110.915 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.7 OUTLIER -64.25 -21.93 66.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.4 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -70.07 -30.66 67.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.718 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.59 -34.4 62.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.66 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.19 -42.73 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.281 0.562 . . . . 0.0 109.525 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.0 t -65.39 -41.43 93.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -62.54 -41.09 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.97 -42.06 97.59 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.27 -50.17 67.53 Favored Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.606 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.23 -20.1 65.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.113 -0.543 . . . . 0.0 110.184 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.476 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.3 m-70 -76.48 -32.27 58.25 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.61 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.32 -33.09 59.3 Favored Glycine 0 N--CA 1.43 -1.7 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.429 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.606 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.2 tt -77.08 -37.2 25.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.468 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.845 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.82 -37.24 59.27 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.845 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -72.71 -33.43 66.44 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.919 0.39 . . . . 0.0 110.853 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 14.7 m-85 -79.7 -35.06 39.61 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.822 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.26 -45.83 79.89 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.747 0.784 . . . . 0.0 108.923 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.8 m -72.59 -45.47 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.168 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -76.15 -54.0 7.46 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.208 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.709 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 8.7 m-85 -78.68 -49.08 13.77 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.507 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -57.07 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.516 -0.874 . . . . 0.0 111.562 -175.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' CYS . . . 38.27 -139.51 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.88 18.75 10.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.956 0.408 . . . . 0.0 110.561 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -90.37 -37.15 14.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.824 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.442 ' CB ' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.17 -15.24 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.069 -179.484 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -58.62 -28.87 37.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.865 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -54.45 -29.96 51.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.821 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.73 26.08 0.3 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.479 -0.867 . . . . 0.0 113.357 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER -110.97 105.74 14.62 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.263 0.554 . . . . 0.0 110.244 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 56' ' ' ALA . 50.8 mt -74.31 -18.87 60.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.16 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.47 -52.17 0.17 Allowed Pre-proline 0 N--CA 1.468 0.428 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.709 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 88.1 Cg_exo -49.88 -49.67 15.39 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 121.728 1.618 . . . . 0.0 112.055 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.41 -49.36 26.25 Favored Glycine 0 CA--C 1.506 -0.503 0 CA-C-N 115.943 -0.572 . . . . 0.0 114.014 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.32 99.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.171 -0.515 . . . . 0.0 111.734 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.5 -34.84 73.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.24 0.543 . . . . 0.0 110.164 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.652 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -74.39 -44.36 52.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.169 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.17 86.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.673 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.1 m-85 -71.4 -54.77 9.61 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.827 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -77.73 -24.19 49.16 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.62 -31.42 45.21 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.605 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 p -91.8 -24.69 5.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.82 -50.53 77.28 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.714 178.297 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.827 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.0 Cg_endo -63.62 -39.75 33.62 Favored 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.923 2.415 . . . . 0.0 111.882 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 73' ' ' LEU . 10.0 tt -57.41 -58.15 9.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.185 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 10.8 mp -55.29 -52.84 62.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.451 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.7 mt -49.78 -52.54 31.18 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.327 0.392 . . . . 0.0 112.041 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 46.9 tp -56.83 -45.41 82.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.717 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.5 mm? -70.47 -38.98 74.51 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.02 -20.9 37.44 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.049 0.452 . . . . 0.0 110.452 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.572 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -93.55 -12.07 30.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.551 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.4 tp . . . . . 0 N--CA 1.456 -0.164 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.322 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 C--O 1.232 0.177 0 CA-C-O 120.762 0.234 . . . . 0.0 112.374 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.22 -44.4 95.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.82 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -67.6 -31.37 71.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.91 -38.41 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.156 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.41 -41.75 84.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.028 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 95.6 mmm -66.05 -34.28 77.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -62.67 -37.84 88.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -65.6 -36.04 82.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -69.71 -48.02 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.999 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -66.13 -32.22 73.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.968 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.71 -49.49 52.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.57 -34.11 77.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.69 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.554 ' HA ' HD23 ' A' ' 21' ' ' LEU . 21.9 t70 -64.45 -49.86 69.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.56 -28.61 69.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.783 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.11 -56.68 8.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.555 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.681 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.2 pp -54.93 -43.97 73.81 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.508 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.681 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 12.8 pt-20 -67.35 -34.01 76.44 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -177.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.622 ' O ' HD13 ' A' ' 27' ' ' LEU . 10.5 m120 -67.71 -54.79 16.56 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.96 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.8 mt -53.52 -49.95 66.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 21' ' ' LEU . 19.6 m -53.68 -42.04 49.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -177.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 HD12 ' A' ' 27' ' ' LEU . 7.2 p -82.02 -39.13 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.425 0.155 . . . . 0.0 111.369 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.622 HD13 ' O ' ' A' ' 23' ' ' ASN . 10.4 mp -61.69 -27.86 69.0 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.77 -38.11 82.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.925 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -68.5 -31.91 71.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.739 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.69 -42.38 74.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.342 0.592 . . . . 0.0 109.7 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.432 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 34.0 t -67.42 -36.64 81.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.315 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -67.82 -44.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.075 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.434 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.86 -44.1 97.47 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.838 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.416 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.92 -49.62 73.79 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.314 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.589 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.72 -20.29 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.276 -0.462 . . . . 0.0 110.208 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.6 m-70 -76.12 -32.24 59.06 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.579 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -33.05 58.71 Favored Glycine 0 N--CA 1.435 -1.425 0 CA-C-N 114.265 -1.334 . . . . 0.0 110.854 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.5 tt -77.4 -37.44 25.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.383 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.58 -38.1 59.4 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.2 -37.78 78.29 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 120.804 0.335 . . . . 0.0 110.982 -178.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.639 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -78.21 -32.69 50.02 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.515 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -58.1 -46.79 84.93 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 176.262 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.4 t -69.93 -53.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.047 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -76.11 -54.91 6.13 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.521 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.78 -45.42 43.79 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.828 -1.533 . . . . 0.0 114.48 -175.236 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.511 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.46 -81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.122 0.419 . . . . 0.0 111.615 -178.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 50.35 -146.39 0.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.497 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.03 9.08 9.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.092 0.472 . . . . 0.0 110.616 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -91.13 -26.53 19.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.208 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.453 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.1 p90 -67.74 -23.39 65.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.455 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 48' ' ' ALA . 32.3 pt -70.66 -28.5 34.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.884 0.373 . . . . 0.0 110.702 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 52' ' ' LYS . 5.3 ttpm? -54.08 -29.55 44.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.913 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.26 37.53 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.594 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -133.96 97.79 3.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.817 0.818 . . . . 0.0 110.731 -179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.61 -19.78 58.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.452 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.626 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.31 -54.68 0.2 Allowed Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 71.0 Cg_exo -50.43 -43.38 44.72 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 121.645 1.563 . . . . 0.0 112.037 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.47 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.8 -46.3 48.6 Favored Glycine 0 CA--C 1.507 -0.467 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.364 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.23 86.11 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.519 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.88 -31.07 71.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.568 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.8 m-30 -77.15 -45.23 27.48 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.926 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.93 -38.95 87.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.716 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 18.6 t80 -71.18 -55.04 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.9 -23.34 48.72 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.54 -28.99 50.48 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 119.867 -1.159 . . . . 0.0 111.652 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -91.66 -30.12 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.32 -49.84 68.26 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.992 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.1 Cg_endo -64.83 -39.09 27.07 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.93 2.42 . . . . 0.0 112.01 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.14 -54.81 42.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.52 -50.8 70.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.767 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 30' ' ' ALA . 72.0 mt -51.0 -51.09 56.49 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.351 0.407 . . . . 0.0 111.977 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 8.8 tt -59.99 -40.4 89.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.684 0.278 . . . . 0.0 111.487 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.2 tp -73.62 -40.52 63.73 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 pp -80.14 -28.47 38.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.594 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.506 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.34 -3.1 58.93 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.263 0.554 . . . . 0.0 109.518 178.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.59 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.4 tp . . . . . 0 C--O 1.232 0.168 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.092 179.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo . . . . . 0 N--CA 1.472 0.247 0 N-CA-C 113.12 0.392 . . . . 0.0 113.12 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.19 -38.1 82.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.702 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -75.09 -39.26 60.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.767 0.317 . . . . 0.0 111.163 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.87 -41.38 95.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.4 -37.1 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.831 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.0 ttm -68.0 -34.18 76.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.94 -41.7 97.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.62 -36.34 78.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.315 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -69.41 -40.82 77.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.839 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -66.43 -46.64 75.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.192 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.14 -27.61 68.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.236 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.32 -43.2 33.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.941 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.47 -33.52 74.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -69.47 -38.29 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.26 -53.98 36.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.822 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -49.25 68.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.8 pt-20 -64.35 -31.53 72.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 0.0 111.057 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.586 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -66.43 -54.1 28.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.167 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 1.0 OUTLIER -53.58 -50.08 66.37 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.422 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.5 m -53.83 -44.98 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.28 -37.25 31.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.125 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 93.0 mt -66.83 -20.41 65.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.102 0.477 . . . . 0.0 109.889 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -70.79 -31.21 67.9 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.739 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.78 66.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.251 178.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.48 -41.53 76.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.8 t -66.25 -40.53 90.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.083 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -63.39 -38.79 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.39 96.85 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.31 178.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.475 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.73 71.57 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.607 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.96 -20.71 65.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.133 -0.533 . . . . 0.0 110.164 178.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.5 m-70 -74.94 -33.3 61.93 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.618 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.81 -33.3 60.32 Favored Glycine 0 N--CA 1.431 -1.673 0 CA-C-N 113.98 -1.464 . . . . 0.0 110.393 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.1 tt -78.05 -35.59 20.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.695 -179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.855 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.8 -37.57 55.54 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.855 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -73.06 -33.24 65.55 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.851 0.358 . . . . 0.0 111.024 -179.107 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.625 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.5 m-30 -79.48 -35.39 40.3 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.927 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -56.36 -46.18 80.12 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.04 -46.11 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.1 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.5 m-85 -76.52 -54.37 6.8 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.702 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 11.1 m-85 -77.31 -48.78 16.49 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -176.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.501 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 49.0 t -56.05 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.763 -175.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 42.63 -143.42 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.96 12.83 9.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.549 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.618 ' HB3' HH21 ' A' ' 54' ' ' ARG . 25.8 m95 -90.66 -32.44 16.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.584 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -63.96 -11.7 30.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.818 0.342 . . . . 0.0 111.313 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.6 pt -65.25 -27.59 42.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.658 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 53' ' ' GLY . 22.2 ptmt -52.67 -43.26 65.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.179 -178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.402 ' N ' ' HG3' ' A' ' 52' ' ' LYS . . . 157.43 38.74 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.254 -0.974 . . . . 0.0 112.997 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.618 HH21 ' HB3' ' A' ' 49' ' ' TRP . 16.0 ptt180 -132.29 102.4 5.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.508 0.671 . . . . 0.0 111.492 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 58' ' ' GLY . 35.0 mt -73.32 -17.48 61.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.048 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.606 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.98 -52.55 0.16 Allowed Pre-proline 0 N--CA 1.465 0.302 0 O-C-N 123.768 0.667 . . . . 0.0 112.52 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.702 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.8 Cg_exo -48.25 -51.16 10.59 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.35 1.367 . . . . 0.0 111.798 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.82 -49.17 29.1 Favored Glycine 0 CA--C 1.509 -0.34 0 CA-C-N 115.978 -0.556 . . . . 0.0 113.896 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.09 99.7 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.063 -0.568 . . . . 0.0 111.776 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.625 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.78 -35.22 74.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.279 0.562 . . . . 0.0 110.219 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.643 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.3 m-30 -73.45 -45.79 52.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.119 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.54 -38.32 89.29 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.8 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.675 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 10.5 m-85 -71.39 -54.49 10.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.69 -24.02 49.4 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.99 -31.67 42.52 Favored Glycine 0 CA--C 1.516 0.147 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.481 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -89.93 -27.44 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.675 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.28 -51.75 60.41 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.95 178.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.7 Cg_endo -62.37 -42.95 25.05 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 123.157 2.571 . . . . 0.0 112.143 -178.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.6 tm? -57.17 -55.31 36.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 88.2 mt -57.89 -55.3 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.399 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 72' ' ' LEU . 4.3 pp -55.16 -38.35 68.16 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.655 ' N ' HD12 ' A' ' 71' ' ' LEU . 47.6 tp -66.83 -44.42 81.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.688 0.28 . . . . 0.0 111.057 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.8 mp -70.97 -36.65 72.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -82.53 -23.82 34.37 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.113 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.42 -5.82 57.08 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 19.2 tp . . . . . 0 C--O 1.232 0.177 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.919 179.316 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo . . . . . 0 C--O 1.231 0.17 0 N-CA-C 112.805 0.271 . . . . 0.0 112.805 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.1 -50.97 62.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.32 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -71.04 -31.16 67.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.67 -40.16 76.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.372 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.87 72.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.176 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.58 -40.32 88.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -62.16 -32.12 72.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.776 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -67.48 -39.95 85.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.568 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -67.34 -40.61 85.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.644 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.41 -40.79 89.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -64.12 -40.62 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.396 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.89 -34.58 75.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.443 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 21' ' ' LEU . 16.2 t70 -67.18 -40.92 86.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.558 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HB2' ' HZ2' ' A' ' 19' ' ' LYS . 10.5 mtmp? -66.74 -28.89 68.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.429 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.09 -56.62 9.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.187 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . 0.674 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.7 pp -55.51 -39.89 71.07 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 120.835 0.35 . . . . 0.0 110.978 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.605 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -69.38 -40.89 77.15 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.453 -176.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.613 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 m-20 -65.7 -55.28 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.476 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 7.3 mt -52.41 -51.6 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 21' ' ' LEU . 26.7 m -52.53 -44.55 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.4 t -76.34 -40.97 35.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.687 0.279 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 86.0 mt -63.9 -21.35 66.42 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.021 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -69.5 -32.96 72.16 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.698 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.33 -31.8 65.98 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.41 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.78 -44.0 71.02 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 38.6 t -65.05 -40.12 94.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.247 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.698 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.05 -40.59 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.08 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.74 98.86 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.681 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.422 ' HA2' ' HD2' ' A' ' 64' ' ' TYR . . . -62.16 -49.6 73.34 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.601 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.4 -20.15 65.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.277 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.5 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 m-70 -76.57 -32.11 57.95 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -32.57 59.29 Favored Glycine 0 N--CA 1.434 -1.483 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.653 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.0 tt -77.68 -36.74 23.2 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.388 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.84 -37.62 58.84 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.88 -36.54 75.53 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 120.842 0.353 . . . . 0.0 111.061 -178.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.605 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.9 m-85 -79.53 -33.33 42.06 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.296 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 46' ' ' CYS . 1.1 mp -57.65 -47.34 82.53 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.759 0.79 . . . . 0.0 108.986 176.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 44' ' ' PHE . 30.1 m -72.49 -50.8 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.329 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . 0.469 ' N ' HG23 ' A' ' 43' ' ' VAL . 36.7 t80 -77.08 -54.25 6.77 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -177.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.02 -45.91 46.84 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 113.967 -1.469 . . . . 0.0 114.195 -175.666 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.8 t -60.04 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.197 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.72 -142.17 0.47 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.23 11.37 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.037 0.446 . . . . 0.0 110.564 178.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -90.92 -28.21 18.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.032 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 1.2 p90 -67.23 -24.64 65.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.4 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 20.2 pt -66.37 -27.45 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 0.0 110.61 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -53.52 -52.35 59.91 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.12 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 169.8 40.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.179 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.487 ' HG2' ' HA ' ' A' ' 50' ' ' TYR . 19.8 ptp180 -144.18 101.46 3.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.595 0.712 . . . . 0.0 111.425 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -73.25 -17.96 61.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.094 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.24 -54.05 0.17 Allowed Pre-proline 0 N--CA 1.468 0.433 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.1 Cg_exo -47.84 -46.41 21.61 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.321 1.348 . . . . 0.0 111.774 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.39 -46.67 44.81 Favored Glycine 0 CA--C 1.507 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.496 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.8 94.92 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.939 -0.631 . . . . 0.0 111.542 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.605 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -63.14 -34.82 78.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.962 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.592 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.85 -44.53 61.27 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.656 179.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.9 88.45 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.857 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 5.7 m-85 -71.22 -54.96 9.15 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -178.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.76 -24.23 49.03 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.09 43.63 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.017 -1.087 . . . . 0.0 111.64 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.58 -26.78 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.84 -52.38 57.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.007 178.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.9 Cg_endo -64.76 -40.66 21.26 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 123.02 2.48 . . . . 0.0 112.501 -177.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER -57.59 -55.65 32.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.199 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.6 -53.93 51.87 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.313 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.5 mt -49.99 -51.67 39.92 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.353 0.408 . . . . 0.0 111.839 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LEU . 65.1 tp -58.36 -46.83 85.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.32 -38.11 81.24 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.91 -21.91 37.1 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.126 0.489 . . . . 0.0 110.122 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.55 -5.76 51.01 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.596 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.411 ' CB ' ' O ' ' A' ' 72' ' ' LEU . 21.3 tp . . . . . 0 CA--C 1.53 0.185 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.186 179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.472 0.236 0 N-CA-C 112.743 0.247 . . . . 0.0 112.743 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -63.16 -39.19 93.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -75.25 -42.0 56.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.68 96.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.35 77.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.012 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.3 ttp -68.59 -32.65 72.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.55 -36.92 79.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.828 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -65.35 -42.85 92.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -62.21 -48.73 78.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -65.34 -30.38 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.994 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -70.98 -33.72 70.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -79.28 -37.1 38.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -67.37 -36.78 82.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.753 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.17 -36.93 75.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.958 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.567 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.12 -52.24 56.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.992 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -48.88 69.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.548 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.4 pt-20 -65.29 -30.74 71.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.774 0.321 . . . . 0.0 111.085 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.431 ' O ' HD13 ' A' ' 27' ' ' LEU . 85.6 m-20 -65.45 -47.9 74.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.033 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 6.2 mt -58.36 -52.47 65.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.034 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.1 m -52.62 -45.63 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.403 ' N ' HG23 ' A' ' 25' ' ' VAL . 40.8 t -73.92 -44.75 50.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.878 0.37 . . . . 0.0 110.889 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.9 OUTLIER -61.24 -21.6 64.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.337 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -70.03 -32.69 70.97 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.714 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.83 -33.41 68.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.52 -0.763 . . . . 0.0 109.431 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.42 -41.3 76.55 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.43 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.5 t -66.14 -38.73 88.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.141 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -66.65 -40.03 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -42.46 97.36 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.306 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.423 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.54 -49.12 76.5 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.643 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.05 -22.24 66.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.984 -0.608 . . . . 0.0 110.023 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.475 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 m-70 -74.47 -33.14 62.8 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.583 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.16 -34.31 61.44 Favored Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 179.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.643 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.2 tt -78.05 -35.94 20.97 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.206 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.565 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.905 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.51 -38.61 59.33 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.905 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.45 -39.15 81.57 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.803 0.335 . . . . 0.0 111.2 -178.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 10.7 m-85 -77.37 -32.82 55.19 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.606 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.655 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.77 -46.75 84.12 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.413 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.96 -54.18 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.028 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -76.13 -54.35 6.96 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 -177.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.505 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.37 -38.24 60.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 113.959 -1.473 . . . . 0.0 114.501 -175.449 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.34 16.35 0.08 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.12 0.418 . . . . 0.0 111.904 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.97 156.73 0.71 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.53 7.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . 0.509 ' H ' ' C ' ' A' ' 47' ' ' ALA . 25.1 m95 -90.65 -24.43 20.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.679 0.276 . . . . 0.0 110.854 178.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -27.67 67.15 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.177 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 48' ' ' ALA . 44.4 pt -68.19 -28.9 42.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.741 0.305 . . . . 0.0 110.809 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -54.37 -34.98 62.29 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.677 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.85 30.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.408 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -127.11 98.85 5.46 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.752 0.787 . . . . 0.0 110.442 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.2 mm? -75.01 -18.89 60.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.778 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.25 -53.82 0.17 Allowed Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 87.0 Cg_exo -48.35 -44.88 28.24 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.639 1.559 . . . . 0.0 112.109 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.59 -47.61 44.82 Favored Glycine 0 CA--C 1.505 -0.555 0 CA-C-N 115.798 -0.637 . . . . 0.0 113.408 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.42 83.98 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.94 -0.63 . . . . 0.0 111.53 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.01 -32.73 74.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.162 0.506 . . . . 0.0 110.054 178.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.655 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.6 m-85 -76.15 -46.49 28.38 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.195 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.57 85.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.584 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.5 t80 -71.26 -55.65 7.65 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -78.15 -23.56 47.69 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.82 -30.21 48.77 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.605 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -91.27 -29.68 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.657 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.52 -50.82 56.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.929 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 39.0 Cg_endo -64.47 -39.77 27.13 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 123.02 2.48 . . . . 0.0 112.126 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tt -57.67 -54.8 42.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.69 -52.73 64.24 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.469 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.54 -50.86 52.24 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 49.9 tp -57.06 -44.73 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.614 0.245 . . . . 0.0 111.497 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 mt -71.29 -38.32 71.8 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pp -82.5 -19.69 38.25 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 110.438 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.489 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -94.86 -8.58 36.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.3 tp . . . . . 0 C--O 1.231 0.111 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.55 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_exo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.686 0.203 . . . . 0.0 112.534 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.22 -58.09 6.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.172 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -60.89 -43.73 98.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.94 -42.55 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.975 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.37 96.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.99 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.7 mtp -63.77 -31.64 72.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.774 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.45 -39.7 92.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -64.23 -48.2 76.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.292 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -58.8 -49.27 78.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.14 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -60.91 -33.84 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.17 -35.95 76.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -73.73 -34.83 64.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.984 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.54 -43.14 70.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.894 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -64.35 -32.06 73.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.163 0.506 . . . . 0.0 110.287 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -66.78 -53.32 34.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.874 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -47.37 72.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.793 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLU . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.2 pt-20 -64.45 -31.37 72.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.923 0.392 . . . . 0.0 111.027 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ASN . . . . . 0.625 ' O ' HD13 ' A' ' 27' ' ' LEU . 6.4 m-20 -66.75 -53.14 36.33 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.771 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt -50.06 -52.16 36.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 22' ' ' GLU . 29.6 m -55.29 -40.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' VAL . . . . . 0.613 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -80.11 -40.66 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.353 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -61.89 -27.14 68.59 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.15 -39.09 82.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.375 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -69.08 -33.82 74.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.247 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.45 -43.85 72.44 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.2 t -65.28 -36.93 85.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.429 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.7 OUTLIER -67.87 -43.3 86.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.987 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ALA . . . . . 0.419 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.73 -43.42 97.91 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.915 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.04 -49.8 71.65 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.447 -0.882 . . . . 0.0 111.206 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.51 -21.26 66.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.085 -0.557 . . . . 0.0 110.215 178.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.469 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 m-70 -75.73 -32.7 60.14 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.65 59.84 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.959 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.6 tt -77.75 -36.86 23.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.52 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.68 -37.19 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -70.32 -38.57 74.96 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 120.865 0.364 . . . . 0.0 111.061 -178.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -77.42 -33.56 54.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.54 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.548 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.17 -47.2 81.79 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.308 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.5 t -70.01 -54.2 20.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.138 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -76.42 -54.37 6.83 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.92 -45.71 48.86 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.484 -175.232 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' CYS . . . . . 0.523 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 31.6 t -59.27 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.463 -178.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.49 -142.39 0.44 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.11 9.08 9.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.948 0.404 . . . . 0.0 110.625 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -90.52 -25.19 20.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.1 p90 -66.08 -26.69 67.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.216 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.43 -28.6 41.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.841 0.353 . . . . 0.0 110.671 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -54.46 -52.34 62.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.143 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.6 42.22 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.31 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.482 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 9.8 ptp180 -147.75 96.28 2.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.635 0.731 . . . . 0.0 111.546 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.512 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -71.41 -18.02 62.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.793 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.547 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.36 -52.41 0.17 Allowed Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . 0.58 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -47.63 -45.18 24.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 121.284 1.323 . . . . 0.0 111.944 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -48.89 44.24 Favored Glycine 0 CA--C 1.505 -0.551 0 CA-C-N 115.941 -0.572 . . . . 0.0 113.523 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.68 88.23 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.938 -0.631 . . . . 0.0 111.373 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.2 -33.97 77.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.212 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . 0.58 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.7 m-85 -74.53 -43.21 56.9 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.812 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.2 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.023 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.0 m-85 -71.13 -54.77 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -77.85 -23.6 48.86 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.58 -29.49 48.33 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 119.888 -1.148 . . . . 0.0 111.617 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.01 -28.5 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.7 -50.44 73.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 114.944 -1.026 . . . . 0.0 111.048 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.6 Cg_endo -65.18 -38.93 25.34 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.082 2.522 . . . . 0.0 112.171 -178.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 1.7 tm? -57.55 -56.49 21.18 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.64 -50.73 71.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.085 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.494 HD13 ' HB1' ' A' ' 30' ' ' ALA . 63.6 mt -49.82 -53.43 25.48 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LEU . . . . . 0.556 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.7 tt -57.21 -42.99 82.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.542 0.21 . . . . 0.0 111.482 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.6 mm? -72.02 -38.2 69.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.65 -20.74 35.68 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.406 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ALA . . . . . 0.56 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -93.25 -4.74 51.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 109.464 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.3 tp . . . . . 0 CA--C 1.529 0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.103 179.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.483 0.891 0 N-CA-C 111.089 -0.389 . . . . 0.0 111.089 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.479 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 2.0 pt? -71.03 -17.7 62.61 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.147 -179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.52 -33.87 60.68 Favored Glycine 0 CA--C 1.519 0.291 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.352 -179.736 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.638 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 48.9 m -57.9 -50.91 85.48 Favored Pre-proline 0 CA--C 1.534 0.359 0 CA-C-N 116.864 0.332 . . . . 0.0 111.864 -179.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.638 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 34.8 Cg_exo -61.32 -35.5 83.83 Favored 'Trans proline' 0 C--N 1.352 0.728 0 C-N-CA 122.126 1.884 . . . . 0.0 112.186 179.535 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -63.95 -38.28 90.49 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.302 -0.408 . . . . 0.0 110.682 179.728 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 74.7 t80 -70.96 -31.73 68.39 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.567 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -73.24 -40.97 64.23 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.217 -179.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -40.22 83.41 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.281 -0.418 . . . . 0.0 111.263 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -68.25 -38.66 82.01 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.911 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -60.76 -41.76 96.11 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.17 -0.468 . . . . 0.0 111.034 -179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.6 t80 -63.34 -30.54 71.66 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.313 -0.403 . . . . 0.0 110.802 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -70.24 -47.94 59.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.568 179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.8 m-20 -63.55 -31.26 72.37 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.824 -179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -72.09 -32.48 67.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.829 179.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -75.85 -40.93 53.75 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.898 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -68.19 -41.95 80.64 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.876 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.425 ' HD3' ' O ' ' A' ' 19' ' ' LYS . 6.8 tmtm? -63.51 -37.0 85.64 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.637 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.56 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.77 -53.0 46.24 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.976 -0.557 . . . . 0.0 111.155 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.498 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.38 -46.6 73.1 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.877 -179.084 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.552 ' HG3' HD22 ' A' ' 23' ' ' ASN . 12.3 pt-20 -65.68 -32.47 74.04 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.741 0.305 . . . . 0.0 111.399 -179.139 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.661 ' O ' HD13 ' A' ' 27' ' ' LEU . 0.9 OUTLIER -67.07 -54.49 20.98 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 120.746 0.308 . . . . 0.0 111.256 -179.861 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.56 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.7 mt -50.72 -52.02 44.34 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 112.083 0.401 . . . . 0.0 112.083 -179.536 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.486 HG22 ' O ' ' A' ' 22' ' ' GLU . 32.7 m -54.84 -42.75 64.44 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.459 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -177.4 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.6 t -77.01 -51.64 18.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-O 120.61 0.243 . . . . 0.0 111.48 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.661 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -53.51 -35.13 60.31 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 116.423 -0.353 . . . . 0.0 110.805 179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -62.38 -38.01 87.96 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.275 -0.42 . . . . 0.0 110.307 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.686 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -67.34 -32.57 73.61 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.997 -0.547 . . . . 0.0 109.763 178.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.466 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.68 -41.27 75.69 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-O 121.304 0.573 . . . . 0.0 109.508 177.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.1 t -67.39 -36.91 82.27 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.244 -0.889 . . . . 0.0 110.359 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.686 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -68.25 -43.63 84.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 115.955 -0.566 . . . . 0.0 109.96 179.66 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.429 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -61.32 -42.87 99.39 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 115.924 -0.58 . . . . 0.0 110.91 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.413 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -63.15 -49.67 69.52 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.428 -0.892 . . . . 0.0 111.117 179.026 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.565 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.53 -20.66 66.43 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.116 -0.542 . . . . 0.0 110.102 178.16 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.8 m-70 -75.79 -31.9 59.66 Favored 'General case' 0 CA--C 1.504 -0.794 0 N-CA-C 107.987 -1.116 . . . . 0.0 107.987 179.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.58 -33.47 58.24 Favored Glycine 0 N--CA 1.435 -1.393 0 CA-C-N 114.315 -1.311 . . . . 0.0 111.097 179.073 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.565 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.9 tt -78.25 -35.99 20.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 C-N-CA 120.944 -0.302 . . . . 0.0 110.45 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.18 -36.49 58.66 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -70.97 -38.26 72.76 Favored 'General case' 0 CA--C 1.51 -0.577 0 CA-C-O 120.798 0.332 . . . . 0.0 111.015 -178.892 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.69 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.48 -33.5 54.51 Favored 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.471 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.694 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.5 OUTLIER -57.93 -46.47 84.96 Favored 'General case' 0 N--CA 1.443 -0.823 0 CA-C-O 121.971 0.891 . . . . 0.0 108.698 176.238 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.44 HG23 ' O ' ' A' ' 39' ' ' LEU . 89.0 t -70.42 -53.26 23.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 CA-C-N 115.291 -0.868 . . . . 0.0 112.093 -179.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.6 m-85 -76.21 -54.39 6.87 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 115.755 1.761 . . . . 0.0 115.755 -177.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.82 -45.7 34.49 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 113.886 -1.507 . . . . 0.0 114.556 -175.266 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.49 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 16.1 t -54.9 -80.85 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 118.054 0.388 . . . . 0.0 111.356 -178.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 51.16 -147.98 0.38 Allowed 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 109.641 -0.504 . . . . 0.0 109.641 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.447 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.3 7.87 9.66 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.928 0.394 . . . . 0.0 110.865 179.296 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 34.9 m95 -90.97 -25.39 19.77 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.191 179.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.401 ' HB2' ' HG2' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.27 -26.29 64.69 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.563 -179.214 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.447 HG12 ' O ' ' A' ' 48' ' ' ALA . 38.9 pt -68.9 -29.48 43.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.823 0.344 . . . . 0.0 111.055 -179.953 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -55.08 -39.16 68.97 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 116.078 -0.51 . . . . 0.0 110.839 179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 162.33 34.06 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.881 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.538 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.2 ttm180 -129.12 95.98 4.2 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.876 0.846 . . . . 0.0 110.569 179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.437 ' O ' ' N ' ' A' ' 58' ' ' GLY . 44.8 mt -75.64 -20.11 58.73 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.36 -0.836 . . . . 0.0 111.726 179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.614 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.48 -54.82 0.2 Allowed Pre-proline 0 N--CA 1.47 0.542 0 N-CA-C 112.971 0.73 . . . . 0.0 112.971 -178.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.614 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.5 Cg_exo -48.74 -42.9 35.95 Favored 'Trans proline' 0 C--N 1.354 0.839 0 C-N-CA 121.696 1.597 . . . . 0.0 112.056 179.097 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.437 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.76 -49.24 41.77 Favored Glycine 0 CA--C 1.506 -0.478 0 CA-C-N 115.906 -0.588 . . . . 0.0 113.42 179.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.52 -38.91 91.81 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 114.896 -0.652 . . . . 0.0 111.262 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.69 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.91 -35.56 80.48 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.965 -0.561 . . . . 0.0 110.343 179.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.694 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.7 m-85 -73.57 -43.13 60.58 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.632 -0.713 . . . . 0.0 109.826 179.006 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.9 -39.31 83.63 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.373 -0.831 . . . . 0.0 111.013 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -70.76 -54.85 10.15 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.458 0.54 . . . . 0.0 112.458 -178.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -78.12 -23.28 47.9 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 111.932 0.345 . . . . 0.0 111.932 -179.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.22 -29.87 48.47 Favored Glycine 0 CA--C 1.518 0.263 0 C-N-CA 119.736 -1.221 . . . . 0.0 111.521 179.157 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.27 -27.21 4.75 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.176 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 178.275 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.667 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.17 -49.95 78.43 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.913 178.534 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.8 Cg_endo -65.78 -38.05 25.35 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 123.161 2.574 . . . . 0.0 112.071 -178.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.1 tt -58.74 -55.13 39.1 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 179.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -56.24 -51.12 69.28 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 115.696 -0.684 . . . . 0.0 110.783 179.07 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.466 HD13 ' HB1' ' A' ' 30' ' ' ALA . 77.5 mt -51.21 -49.41 61.09 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.387 0.429 . . . . 0.0 111.667 -179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.655 HD12 HD23 ' A' ' 27' ' ' LEU . 31.0 tp -57.12 -45.76 83.2 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.712 0.291 . . . . 0.0 111.229 -179.851 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 7.6 tt -71.25 -38.61 71.91 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 112.886 0.699 . . . . 0.0 112.886 -178.772 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 0.9 OUTLIER -81.59 -23.62 36.97 Favored 'General case' 0 N--CA 1.463 0.216 0 C-N-CA 120.629 -0.429 . . . . 0.0 110.733 -179.834 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.632 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -91.42 -0.38 57.62 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 121.41 0.624 . . . . 0.0 109.377 178.343 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.54 HD12 ' HD2' ' A' ' 77' ' ' PRO . 18.9 tp -109.33 135.61 20.25 Favored Pre-proline 0 CA--C 1.531 0.244 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.366 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.54 ' HD2' HD12 ' A' ' 76' ' ' LEU . 75.4 Cg_exo -49.98 158.3 2.28 Favored 'Trans proline' 0 C--N 1.351 0.669 0 C-N-CA 122.508 2.138 . . . . 0.0 112.439 -179.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.499 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 31.0 Cg_endo -62.75 -50.79 3.68 Favored 'Trans proline' 0 C--N 1.349 0.556 0 C-N-CA 122.351 2.034 . . . . 0.0 113.023 -179.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 14.3 mmm180 -64.64 -23.04 67.13 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 120.948 0.404 . . . . 0.0 110.978 -179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.496 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -76.72 -47.14 22.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.018 -0.537 . . . . 0.0 111.361 -179.843 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.499 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -74.04 -24.54 59.55 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.882 0.372 . . . . 0.0 110.42 -179.676 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.69 -41.52 65.22 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.961 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.85 -18.71 63.45 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.804 179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.89 -10.6 56.95 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.983 179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -90.74 148.61 22.46 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.049 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 65.6 p . . . . . 0 C--O 1.249 1.057 0 CA-C-O 118.244 -0.884 . . . . 0.0 110.965 -179.953 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 111.222 -0.338 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 88.5 mt -70.12 -18.65 63.24 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.077 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.81 -33.75 59.93 Favored Glycine 0 CA--C 1.519 0.334 0 C-N-CA 120.884 -0.674 . . . . 0.0 113.254 -179.914 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.489 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 63.1 m -52.13 -51.3 72.9 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.489 ' HD2' ' N ' ' A' ' 5' ' ' SER . 36.2 Cg_endo -66.22 -28.84 47.62 Favored 'Trans proline' 0 C--N 1.352 0.719 0 C-N-CA 121.939 1.759 . . . . 0.0 112.658 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -64.43 -49.61 70.84 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.094 179.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -67.23 -42.45 83.99 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.398 -0.365 . . . . 0.0 111.218 -179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.21 -36.75 80.75 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.13 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.7 -37.09 67.94 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.951 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 52.3 tpp -65.91 -34.88 79.15 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.574 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.2 t70 -66.0 -35.79 81.54 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.855 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.8 t80 -64.64 -41.99 95.77 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.133 -0.485 . . . . 0.0 110.695 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -64.95 -48.73 73.02 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.108 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -63.49 -33.29 75.24 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.422 -179.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -73.07 -33.91 65.93 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.39 -0.368 . . . . 0.0 111.066 -179.64 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.4 t70 -73.79 -40.76 63.19 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.965 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -68.98 -35.32 76.59 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.948 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.2 ttpp -66.0 -40.71 91.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 0.0 110.76 179.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.586 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.31 -48.12 74.2 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.62 179.596 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.13 -49.52 69.02 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.44 -179.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -67.64 -31.46 71.48 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.87 0.366 . . . . 0.0 110.723 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.626 ' O ' HD13 ' A' ' 27' ' ' LEU . 26.8 t-20 -61.42 -53.86 51.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.968 -179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.8 mt -55.55 -39.88 71.16 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.799 0.333 . . . . 0.0 110.672 179.769 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.9 t -53.74 -46.12 62.09 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.122 0 CA-C-N 115.804 -0.635 . . . . 0.0 110.909 -178.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 48.4 t -73.6 -41.05 55.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.538 179.232 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.1 mp -58.6 -27.6 64.81 Favored 'General case' 0 CA--C 1.522 -0.102 0 N-CA-C 109.925 -0.398 . . . . 0.0 109.925 179.15 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.81 -32.57 71.08 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.218 179.802 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.702 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.32 -36.05 63.67 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.083 -0.508 . . . . 0.0 109.884 178.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.49 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.09 -40.41 78.41 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 177.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 32.3 t -67.66 -39.42 84.54 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.09 -0.959 . . . . 0.0 110.276 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.702 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.6 -41.59 92.69 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.3 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 179.236 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.8 -41.08 97.3 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.651 -0.704 . . . . 0.0 110.457 179.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.31 -49.97 69.29 Favored Glycine 0 N--CA 1.45 -0.409 0 C-N-CA 120.534 -0.841 . . . . 0.0 111.183 179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.603 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.96 -20.18 65.03 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.32 -0.44 . . . . 0.0 110.262 178.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.473 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.8 m-70 -75.77 -31.68 59.61 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 179.185 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.639 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.61 -31.5 56.28 Favored Glycine 0 N--CA 1.433 -1.564 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.511 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.688 ' O ' HD13 ' A' ' 42' ' ' LEU . 13.9 tt -78.43 -35.11 18.85 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.199 0 C-N-CA 120.813 -0.355 . . . . 0.0 110.215 179.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.807 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.94 -35.79 50.02 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.896 -179.481 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.807 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.8 p -71.52 -37.96 71.14 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-O 121.072 0.463 . . . . 0.0 110.537 -179.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.647 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.6 m-85 -75.56 -35.9 60.53 Favored 'General case' 0 C--N 1.318 -0.767 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.483 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.688 HD13 ' O ' ' A' ' 38' ' ' ILE . 2.2 mp -56.89 -43.71 81.57 Favored 'General case' 0 N--CA 1.449 -0.475 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.751 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 39' ' ' LEU . 82.2 t -70.86 -47.79 60.77 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.673 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.751 -179.635 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -75.47 -53.7 8.23 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 115.124 1.527 . . . . 0.0 115.124 -178.103 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.72 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 17.0 m-85 -80.98 -48.15 12.66 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -176.463 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.588 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.0 t -62.19 1.99 0.27 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 120.096 -0.642 . . . . 0.0 112.703 -175.272 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.536 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -44.54 153.7 0.15 Allowed 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.413 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -58.94 5.69 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 112.165 0.432 . . . . 0.0 112.165 -178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.536 ' H ' ' C ' ' A' ' 47' ' ' ALA . 38.8 m95 -90.2 -23.49 21.26 Favored 'General case' 0 N--CA 1.454 -0.229 0 CA-C-O 120.603 0.24 . . . . 0.0 111.076 179.301 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.478 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.03 -14.09 62.83 Favored 'General case' 0 CA--C 1.529 0.149 0 CA-C-O 120.865 0.364 . . . . 0.0 110.755 -179.789 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.413 HG12 ' O ' ' A' ' 48' ' ' ALA . 14.6 pt -68.55 -26.9 34.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.511 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -52.35 -39.77 61.12 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-N 116.29 -0.414 . . . . 0.0 111.357 -178.701 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 157.08 39.14 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.443 0 C-N-CA 120.178 -1.011 . . . . 0.0 112.986 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.567 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.5 ptt180 -135.11 102.34 5.16 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 121.751 0.786 . . . . 0.0 111.619 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.533 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -73.17 -17.5 61.37 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.522 178.589 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.05 -51.86 0.15 Allowed Pre-proline 0 N--CA 1.467 0.38 0 N-CA-C 112.784 0.661 . . . . 0.0 112.784 -178.846 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.72 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.1 Cg_exo -47.82 -48.5 15.85 Favored 'Trans proline' 0 C--N 1.354 0.868 0 C-N-CA 121.418 1.412 . . . . 0.0 112.019 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.407 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.57 -48.26 28.73 Favored Glycine 0 CA--C 1.508 -0.37 0 CA-C-N 115.762 -0.654 . . . . 0.0 114.066 179.679 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.11 -39.94 93.81 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 115.357 -0.421 . . . . 0.0 111.969 -178.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.647 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.47 -31.5 72.24 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.313 0.578 . . . . 0.0 110.175 179.172 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.656 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -78.05 -45.13 24.42 Favored 'General case' 0 CA--C 1.512 -0.512 0 CA-C-N 115.37 -0.832 . . . . 0.0 110.207 179.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.24 -35.87 81.55 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.239 179.43 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.4 t80 -71.33 -55.29 8.3 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.328 -179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.807 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -78.33 -23.19 47.12 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.483 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -79.31 -29.39 49.99 Favored Glycine 0 CA--C 1.517 0.194 0 C-N-CA 119.994 -1.098 . . . . 0.0 111.29 179.273 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.82 -28.46 4.69 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.254 0 N-CA-C 108.989 -0.745 . . . . 0.0 108.989 178.16 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.29 -49.91 73.74 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.669 178.72 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.807 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.4 Cg_endo -62.75 -39.51 42.27 Favored 'Trans proline' 0 N--CA 1.448 -1.159 0 C-N-CA 122.887 2.391 . . . . 0.0 111.611 -179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 73' ' ' LEU . 10.1 tt -57.36 -59.41 5.18 Favored 'General case' 0 C--N 1.329 -0.319 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 179.282 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.0 mp -51.02 -50.82 57.81 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.723 -0.671 . . . . 0.0 110.729 178.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.49 HD13 ' HB1' ' A' ' 30' ' ' ALA . 98.2 mt -52.62 -45.6 66.67 Favored 'General case' 0 C--N 1.329 -0.291 0 O-C-N 123.275 0.36 . . . . 0.0 111.75 -179.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 7.5 tt -62.19 -44.74 95.91 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.697 -0.228 . . . . 0.0 111.341 -179.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.4 mp -71.54 -38.58 71.04 Favored 'General case' 0 N--CA 1.469 0.518 0 N-CA-C 112.608 0.596 . . . . 0.0 112.608 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -80.57 -28.04 37.31 Favored 'General case' 0 C--N 1.332 -0.176 0 C-N-CA 120.826 -0.35 . . . . 0.0 110.743 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.553 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.87 -0.04 55.78 Favored 'General case' 0 C--N 1.33 -0.28 0 N-CA-C 109.149 -0.686 . . . . 0.0 109.149 178.197 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.617 HD12 ' HD2' ' A' ' 77' ' ' PRO . 39.6 tp -116.54 129.49 25.23 Favored Pre-proline 0 C--O 1.231 0.117 0 CA-C-N 114.628 -1.169 . . . . 0.0 109.91 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.617 ' HD2' HD12 ' A' ' 76' ' ' LEU . 88.3 Cg_exo -48.31 132.1 23.5 Favored 'Trans proline' 0 C--N 1.347 0.499 0 C-N-CA 122.016 1.811 . . . . 0.0 111.493 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 77.1 Cg_exo -50.64 -36.43 50.4 Favored 'Trans proline' 0 C--N 1.349 0.588 0 C-N-CA 122.515 2.143 . . . . 0.0 112.369 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 53.1 ttp180 -66.77 -29.44 69.39 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.28 179.631 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.476 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -71.15 -55.31 8.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.078 179.533 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.494 ' HB2' HD23 ' A' ' 76' ' ' LEU . 14.2 t80 -68.63 -19.44 64.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 116.373 -0.376 . . . . 0.0 111.121 -179.387 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.04 -49.97 45.92 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.985 0.421 . . . . 0.0 110.575 179.368 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.47 -11.32 60.73 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.974 -0.557 . . . . 0.0 111.113 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -87.18 -13.6 43.53 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.247 -0.433 . . . . 0.0 110.97 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.22 139.36 30.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 0.0 111.207 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.7 p . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.24 -0.886 . . . . 0.0 110.986 179.98 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo . . . . . 0 N--CA 1.484 0.939 0 N-CA-C 111.194 -0.349 . . . . 0.0 111.194 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.408 HD12 ' N ' ' A' ' 3' ' ' LEU . 8.7 mp -71.56 -18.96 62.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.242 -0.435 . . . . 0.0 111.167 -179.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.26 -33.76 58.68 Favored Glycine 0 CA--C 1.52 0.397 0 C-N-CA 120.887 -0.673 . . . . 0.0 113.2 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.495 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 49.7 m -54.0 -50.67 82.87 Favored Pre-proline 0 CA--C 1.536 0.42 0 N-CA-C 112.613 0.597 . . . . 0.0 112.613 -179.059 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.495 ' HD2' ' N ' ' A' ' 5' ' ' SER . 55.5 Cg_endo -69.45 -38.75 8.04 Favored 'Trans proline' 0 C--N 1.353 0.768 0 C-N-CA 122.096 1.864 . . . . 0.0 113.082 -179.542 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -60.25 -45.28 93.83 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.497 -179.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -69.3 -37.23 77.71 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.185 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.92 -33.52 73.88 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.241 -0.436 . . . . 0.0 111.294 -179.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.77 -41.48 62.39 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.112 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -63.76 -32.0 73.36 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.796 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -66.95 -37.27 83.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.144 -0.48 . . . . 0.0 110.745 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -64.22 -45.26 89.05 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.146 -0.479 . . . . 0.0 111.001 -179.846 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.5 tppp? -61.85 -51.09 69.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.888 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -60.45 -39.97 89.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.267 -179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -64.33 -34.74 78.83 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.096 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -74.3 -37.27 63.69 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.015 -179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -70.55 -32.88 70.48 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.981 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -72.23 -38.33 68.98 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 116.31 -0.405 . . . . 0.0 110.826 -179.772 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.471 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.94 -50.36 56.42 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.882 179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.451 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.96 -48.68 72.89 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.271 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.451 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.8 pt-20 -63.96 -33.98 76.95 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.622 0.248 . . . . 0.0 110.794 -179.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.564 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 7.7 m120 -58.83 -52.55 65.26 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 110.009 -0.367 . . . . 0.0 110.009 179.342 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.471 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 2.4 mt -48.17 -50.4 29.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.524 179.252 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.423 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.1 t -49.75 -53.92 8.76 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 116.063 -0.517 . . . . 0.0 112.276 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 40.6 t -69.56 -45.66 77.63 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.577 -179.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 73.3 mt -61.52 -24.34 66.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.705 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -67.27 -30.4 70.27 Favored 'General case' 0 CA--C 1.518 -0.268 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.84 -31.28 66.35 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.007 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -40.98 76.71 Favored 'General case' 0 C--N 1.326 -0.439 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 177.264 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.459 ' HB2' HD21 ' A' ' 72' ' ' LEU . 33.7 t -65.32 -43.27 91.54 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-N 115.085 -0.961 . . . . 0.0 109.997 179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -62.28 -40.43 87.76 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 CA-C-N 115.724 -0.671 . . . . 0.0 109.51 179.287 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.44 -43.18 99.33 Favored 'General case' 0 C--N 1.333 -0.148 0 CA-C-N 115.693 -0.685 . . . . 0.0 110.608 179.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.75 -49.54 75.12 Favored Glycine 0 N--CA 1.451 -0.341 0 N-CA-C 111.012 -0.835 . . . . 0.0 111.012 178.834 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.612 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.81 -19.94 65.13 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 115.146 -0.527 . . . . 0.0 110.352 178.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.463 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.7 m-70 -76.17 -31.57 58.58 Favored 'General case' 0 CA--C 1.499 -0.99 0 N-CA-C 107.715 -1.217 . . . . 0.0 107.715 179.081 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -75.26 -32.0 56.37 Favored Glycine 0 N--CA 1.431 -1.675 0 CA-C-N 114.132 -1.395 . . . . 0.0 110.531 178.606 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.612 HG22 ' O ' ' A' ' 35' ' ' ALA . 12.9 tt -77.67 -36.2 22.48 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.168 0 C-N-CA 120.867 -0.333 . . . . 0.0 110.285 179.768 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.811 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.08 -36.29 55.92 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 112.081 0.4 . . . . 0.0 112.081 -179.437 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.811 ' N ' HD12 ' A' ' 39' ' ' LEU . 48.6 p -71.15 -36.37 72.04 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-O 120.953 0.406 . . . . 0.0 110.649 -179.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 17.0 m-85 -78.23 -35.98 47.65 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 115.715 -0.675 . . . . 0.0 110.625 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.523 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.5 OUTLIER -55.74 -46.11 77.86 Favored 'General case' 0 N--CA 1.446 -0.671 0 CA-C-O 121.92 0.867 . . . . 0.0 108.709 176.551 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.8 t -70.33 -49.36 54.58 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.664 0 CA-C-N 114.69 -1.141 . . . . 0.0 112.123 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.412 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.4 m-85 -75.98 -54.0 7.53 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.965 1.839 . . . . 0.0 115.965 -177.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.697 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 6.8 m-85 -77.18 -48.68 16.97 Favored 'General case' 0 CA--C 1.505 -0.772 0 N-CA-C 115.193 1.553 . . . . 0.0 115.193 -176.174 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.479 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 40.4 t -53.1 -81.28 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 119.778 -0.769 . . . . 0.0 111.568 -175.459 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 41.51 -141.57 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 -179.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.458 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 13.11 9.95 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 120.885 0.374 . . . . 0.0 110.729 178.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 20.1 m95 -91.18 -26.27 19.14 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.121 -0.49 . . . . 0.0 111.264 179.776 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.501 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -69.02 -31.55 70.44 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.523 -0.308 . . . . 0.0 111.332 -179.117 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.458 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.8 pt -61.34 -28.15 43.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-O 120.873 0.368 . . . . 0.0 110.436 179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 60.0 tttp -54.06 -50.89 65.72 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.077 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.25 40.62 0.04 OUTLIER Glycine 0 C--N 1.331 0.283 0 C-N-CA 120.035 -1.079 . . . . 0.0 113.877 179.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.563 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 8.0 ptm180 -148.39 105.46 3.61 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-O 121.741 0.782 . . . . 0.0 111.83 178.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.432 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.3 pp -74.46 -17.8 60.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.597 178.623 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.593 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.81 -51.98 0.15 Allowed Pre-proline 0 N--CA 1.468 0.468 0 N-CA-C 112.833 0.679 . . . . 0.0 112.833 -178.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.697 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 90.7 Cg_exo -47.86 -49.17 14.26 Favored 'Trans proline' 0 C--N 1.353 0.803 0 C-N-CA 121.331 1.354 . . . . 0.0 111.878 178.868 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.432 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -49.15 -49.68 29.98 Favored Glycine 0 CA--C 1.505 -0.564 0 CA-C-N 115.995 -0.548 . . . . 0.0 113.616 179.271 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.67 -42.42 99.61 Favored 'General case' 0 C--N 1.312 -1.024 0 CA-C-N 115.017 -0.592 . . . . 0.0 111.619 -179.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.43 -36.97 76.9 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.296 0.57 . . . . 0.0 110.217 179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.633 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.2 m-30 -72.07 -46.49 56.67 Favored 'General case' 0 CA--C 1.513 -0.444 0 CA-C-N 115.364 -0.835 . . . . 0.0 110.025 179.416 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.69 -37.8 88.82 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.704 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.612 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.4 m-85 -71.51 -54.18 11.41 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -179.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.82 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.66 -24.59 49.36 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.821 0.304 . . . . 0.0 111.821 -179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.78 -31.54 43.97 Favored Glycine 0 N--CA 1.452 -0.242 0 C-N-CA 120.158 -1.02 . . . . 0.0 111.54 179.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.26 -25.79 5.24 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.122 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 178.019 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.632 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.05 -51.69 59.64 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-N 114.88 -1.054 . . . . 0.0 110.639 178.331 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.82 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.72 -39.4 26.76 Favored 'Trans proline' 0 N--CA 1.443 -1.457 0 C-N-CA 122.95 2.434 . . . . 0.0 112.257 -178.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.2 tt -58.26 -54.42 47.16 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.844 0.354 . . . . 0.0 110.415 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.538 ' HG ' HD23 ' A' ' 74' ' ' LEU . 6.4 tp -58.01 -53.8 54.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.261 179.81 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 91.7 mt -49.37 -52.57 27.46 Favored 'General case' 0 C--N 1.33 -0.254 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -179.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.545 HD13 ' HB3' ' A' ' 27' ' ' LEU . 2.7 mm? -57.55 -45.08 85.55 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 111.844 0.313 . . . . 0.0 111.844 -179.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 85.5 mt -69.62 -38.45 77.23 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 112.713 0.634 . . . . 0.0 112.713 -178.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.538 HD23 ' HG ' ' A' ' 70' ' ' LEU . 1.7 pp -82.27 -19.97 38.47 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.028 0.442 . . . . 0.0 110.201 179.829 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -93.95 -7.17 43.7 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.731 -0.668 . . . . 0.0 109.761 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.593 HD12 ' HD2' ' A' ' 77' ' ' PRO . 17.2 tp -99.93 134.97 20.58 Favored Pre-proline 0 CA--C 1.532 0.26 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.129 179.541 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.593 ' HD2' HD12 ' A' ' 76' ' ' LEU . 88.3 Cg_exo -45.22 152.85 0.61 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.585 2.19 . . . . 0.0 112.873 -179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.488 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 31.4 Cg_exo -58.97 -50.78 8.13 Favored 'Trans proline' 0 C--N 1.349 0.563 0 C-N-CA 122.525 2.15 . . . . 0.0 113.044 -179.474 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.2 ttt180 -63.6 -25.93 68.45 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.956 0.407 . . . . 0.0 110.976 -179.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.49 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.32 -47.63 26.89 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.63 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -76.17 -28.11 57.22 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.757 0.313 . . . . 0.0 110.992 -179.299 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -68.79 -45.68 70.68 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.632 179.683 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -67.9 -18.41 64.78 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.767 179.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -78.09 -14.69 59.4 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.016 -0.538 . . . . 0.0 111.049 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.79 143.06 27.67 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.176 -0.465 . . . . 0.0 111.136 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 C--O 1.25 1.095 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.818 -179.886 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.5 Cg_endo . . . . . 0 N--CA 1.484 0.923 0 N-CA-C 111.283 -0.314 . . . . 0.0 111.283 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 3' ' ' LEU . 2.6 pt? -68.43 -18.57 64.46 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.198 -179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.52 -36.12 59.1 Favored Glycine 0 CA--C 1.52 0.345 0 C-N-CA 120.874 -0.679 . . . . 0.0 113.312 -179.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 65.7 m -54.31 -51.11 80.77 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 112.339 0.496 . . . . 0.0 112.339 -179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 5' ' ' SER . 59.3 Cg_endo -71.9 -28.48 16.42 Favored 'Trans proline' 0 C--N 1.351 0.677 0 C-N-CA 122.302 2.002 . . . . 0.0 112.682 -179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -61.59 -56.12 23.35 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.468 -179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -68.18 -31.38 70.89 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.525 -179.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.31 -44.27 83.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.423 -0.353 . . . . 0.0 111.231 -179.834 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.52 -27.6 63.32 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.055 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.9 ttt -73.7 -38.19 64.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.629 179.897 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -64.12 -33.32 75.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.836 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -69.17 -37.62 78.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 5.1 tppp? -69.35 -42.07 75.75 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.324 -0.398 . . . . 0.0 110.795 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -66.26 -43.86 85.3 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.947 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.68 -38.37 90.09 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.945 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -70.73 -36.65 73.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.345 -0.389 . . . . 0.0 110.828 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -70.72 -34.22 71.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.207 -0.451 . . . . 0.0 111.056 -179.814 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -71.1 -39.44 72.1 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.938 0.399 . . . . 0.0 110.719 -179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.464 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.25 -47.8 75.48 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.848 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.42 ' O ' HG23 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -56.14 -49.64 73.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.634 -179.685 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -64.47 -33.25 75.46 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.783 0.325 . . . . 0.0 110.76 -179.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.464 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.7 m120 -60.7 -41.09 94.49 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.434 179.525 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.464 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.6 mt -59.51 -48.34 82.03 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.001 0.429 . . . . 0.0 110.786 179.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.452 HG23 ' H ' ' A' ' 25' ' ' VAL . 3.4 t -49.87 -53.58 10.1 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.68 0 CA-C-N 115.577 -0.738 . . . . 0.0 112.371 -178.681 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.612 HG23 HD13 ' A' ' 27' ' ' LEU . 4.8 m -71.49 -39.17 70.5 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.461 -0.336 . . . . 0.0 111.424 -179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.612 HD13 HG23 ' A' ' 26' ' ' VAL . 1.5 mp -63.66 -24.24 67.7 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-O 120.904 0.383 . . . . 0.0 110.285 179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -69.53 -32.11 70.74 Favored 'General case' 0 C--N 1.33 -0.26 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.722 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.53 -33.9 67.19 Favored 'General case' 0 N--CA 1.451 -0.413 0 CA-C-N 115.358 -0.837 . . . . 0.0 109.725 178.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.47 -43.79 72.5 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.281 0.562 . . . . 0.0 109.623 177.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.423 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -64.18 -38.67 91.88 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.203 179.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.722 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.6 OUTLIER -66.26 -40.56 87.17 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.405 0 CA-C-N 115.855 -0.611 . . . . 0.0 109.448 179.023 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.64 -43.28 93.93 Favored 'General case' 0 C--O 1.232 0.14 0 CA-C-N 115.719 -0.673 . . . . 0.0 110.514 178.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.436 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.14 77.18 Favored Glycine 0 N--CA 1.449 -0.435 0 N-CA-C 111.092 -0.803 . . . . 0.0 111.092 178.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.567 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.08 -20.47 66.18 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.085 -0.558 . . . . 0.0 110.109 178.524 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.471 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.3 m-70 -75.99 -32.32 59.4 Favored 'General case' 0 CA--C 1.503 -0.855 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 179.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.588 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.07 -34.08 58.85 Favored Glycine 0 N--CA 1.433 -1.542 0 CA-C-N 114.146 -1.388 . . . . 0.0 110.888 178.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.567 HG22 ' HA ' ' A' ' 35' ' ' ALA . 17.5 tt -77.27 -37.22 25.28 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.22 0 C-N-CA 121.037 -0.265 . . . . 0.0 110.359 -179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.25 -38.23 60.62 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -179.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.54 -38.57 77.53 Favored 'General case' 0 CA--C 1.511 -0.538 0 C-N-CA 120.888 -0.325 . . . . 0.0 111.252 -178.69 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.0 m-85 -77.68 -33.49 53.25 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.577 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.28 -47.07 82.39 Favored 'General case' 0 N--CA 1.444 -0.753 0 CA-C-O 121.919 0.866 . . . . 0.0 108.838 176.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 96.7 t -69.83 -54.41 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.67 0 CA-C-N 114.926 -1.034 . . . . 0.0 112.169 -179.26 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.4 m-85 -76.36 -54.42 6.78 Favored 'General case' 0 CA--C 1.546 0.807 0 N-CA-C 115.879 1.807 . . . . 0.0 115.879 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.541 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.32 -46.0 52.03 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 113.877 -1.51 . . . . 0.0 114.395 -175.347 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.533 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -60.02 -81.42 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 120.496 -0.481 . . . . 0.0 111.445 -178.883 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.76 -141.08 0.36 Allowed 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 110.029 -0.36 . . . . 0.0 110.029 -179.105 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -119.08 9.97 11.98 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.077 0.465 . . . . 0.0 110.317 178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.7 t-105 -90.26 -27.94 19.14 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.95 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.571 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.2 p90 -66.85 -40.21 87.85 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.318 -0.401 . . . . 0.0 110.824 -179.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -63.89 -28.73 45.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.352 179.625 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 2.0 tmtp? -54.82 -52.05 63.91 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.97 -0.559 . . . . 0.0 110.825 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 176.02 44.77 0.06 OUTLIER Glycine 0 C--N 1.334 0.434 0 C-N-CA 120.097 -1.049 . . . . 0.0 113.375 179.453 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.494 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 17.2 ptp180 -157.68 102.44 1.87 Allowed 'General case' 0 CA--C 1.533 0.312 0 CA-C-O 121.696 0.76 . . . . 0.0 111.653 179.238 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 pp -73.9 -18.38 60.91 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.167 179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.575 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.17 -52.99 0.17 Allowed Pre-proline 0 N--CA 1.47 0.534 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 -178.208 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.575 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 86.1 Cg_exo -48.37 -42.9 33.68 Favored 'Trans proline' 0 C--N 1.354 0.85 0 C-N-CA 121.486 1.457 . . . . 0.0 112.16 179.127 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.43 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -46.91 48.77 Favored Glycine 0 CA--C 1.505 -0.535 0 CA-C-N 115.905 -0.588 . . . . 0.0 113.105 178.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.72 -38.06 89.7 Favored 'General case' 0 C--N 1.312 -1.029 0 CA-C-N 114.804 -0.698 . . . . 0.0 111.447 -179.514 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.62 -32.06 73.55 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.02 0.438 . . . . 0.0 110.318 179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.572 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-85 -76.37 -49.35 17.05 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.333 179.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.07 -39.25 93.65 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.836 -179.855 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.5 t80 -71.15 -54.71 10.1 Favored 'General case' 0 C--N 1.326 -0.438 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -178.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.81 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.57 -23.94 49.89 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 111.859 0.318 . . . . 0.0 111.859 -179.789 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.52 -29.47 48.71 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.144 -1.027 . . . . 0.0 111.672 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.1 p -91.28 -29.03 4.73 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.132 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.76 -50.43 73.58 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-N 114.802 -1.09 . . . . 0.0 111.187 179.123 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.81 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.8 Cg_endo -64.37 -40.46 24.75 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 C-N-CA 122.962 2.442 . . . . 0.0 112.075 -178.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -57.93 -54.75 43.42 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 120.901 0.382 . . . . 0.0 110.01 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 71.7 mt -57.97 -53.34 59.35 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.411 179.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 86.7 mt -49.58 -52.87 27.16 Favored 'General case' 0 N--CA 1.464 0.228 0 O-C-N 123.433 0.458 . . . . 0.0 112.11 -179.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.421 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 58.8 tp -56.81 -46.21 81.77 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.634 0.254 . . . . 0.0 111.614 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.0 tt -69.6 -37.96 77.11 Favored 'General case' 0 N--CA 1.466 0.368 0 N-CA-C 112.888 0.699 . . . . 0.0 112.888 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.6 pp -82.62 -21.72 35.02 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 121.002 0.429 . . . . 0.0 110.243 179.844 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.529 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -91.25 -10.41 41.62 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.581 178.394 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.67 HD12 ' HD2' ' A' ' 77' ' ' PRO . 24.8 tp -94.2 133.47 27.3 Favored Pre-proline 0 CA--C 1.533 0.304 0 CA-C-N 115.16 -0.927 . . . . 0.0 110.086 179.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.67 ' HD2' HD12 ' A' ' 76' ' ' LEU . 96.0 Cg_exo -43.51 152.3 0.3 Allowed 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 122.709 2.273 . . . . 0.0 112.905 -179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.465 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 32.0 Cg_exo -57.86 -53.33 4.55 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 122.448 2.099 . . . . 0.0 113.07 -179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.4 ptp180 -63.26 -25.45 68.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.455 -0.339 . . . . 0.0 110.999 -179.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.443 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.49 -46.88 29.68 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.577 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.465 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.5 OUTLIER -75.72 -21.52 57.44 Favored 'General case' 0 C--N 1.333 -0.13 0 C-N-CA 120.829 -0.348 . . . . 0.0 110.459 -179.511 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.53 -45.22 62.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.595 179.476 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.14 -16.26 63.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.995 -0.548 . . . . 0.0 110.742 179.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.79 -12.3 53.93 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.888 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.22 -176.84 4.48 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.161 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.3 t . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.298 -0.858 . . . . 0.0 110.81 -179.919 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo . . . . . 0 N--CA 1.481 0.793 0 N-CA-C 111.053 -0.403 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.406 ' C ' ' HD2' ' A' ' 6' ' ' PRO . 39.8 tp -66.4 -18.57 65.43 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.897 -179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.42 -33.66 61.14 Favored Glycine 0 CA--C 1.519 0.316 0 C-N-CA 120.965 -0.636 . . . . 0.0 113.198 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.466 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 59.9 m -54.26 -51.26 79.27 Favored Pre-proline 0 CA--C 1.534 0.352 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.249 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.466 ' HD2' ' N ' ' A' ' 5' ' ' SER . 60.0 Cg_endo -72.38 -28.26 15.16 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 122.044 1.829 . . . . 0.0 112.008 179.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.06 -43.45 98.87 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.986 -0.552 . . . . 0.0 111.047 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -69.22 -47.75 63.92 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.165 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -59.78 -37.07 78.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 0.0 111.277 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.44 -32.55 64.43 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.453 -179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 44.2 ttp -69.54 -45.48 68.69 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.255 -0.429 . . . . 0.0 111.016 -179.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -62.12 -31.44 71.91 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.393 -0.367 . . . . 0.0 110.755 179.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.9 t80 -66.61 -40.71 88.96 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.737 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.408 ' HA ' ' OD2' ' A' ' 17' ' ' ASP . 24.6 ttmm -64.26 -48.0 77.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.706 179.82 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -66.35 -24.26 66.48 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.823 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -72.17 -53.18 13.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.093 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.408 ' OD2' ' HA ' ' A' ' 14' ' ' LYS . 3.0 p30 -67.63 -30.81 70.47 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.42 -0.355 . . . . 0.0 110.978 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -68.83 -45.64 70.63 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.014 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 52.8 tttm -64.9 -36.56 84.76 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.883 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.495 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -63.72 -51.3 65.59 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.361 -0.381 . . . . 0.0 110.833 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.409 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.9 -49.51 71.05 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.638 -179.671 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.409 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.4 pt-20 -63.68 -35.07 79.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.724 0.297 . . . . 0.0 111.141 -179.173 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.479 ' O ' HD13 ' A' ' 27' ' ' LEU . 9.9 m120 -59.82 -43.76 94.37 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.376 -0.375 . . . . 0.0 110.687 179.882 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.495 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.9 mt -58.08 -48.58 79.73 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.884 0.373 . . . . 0.0 111.03 179.755 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.432 HG23 ' H ' ' A' ' 25' ' ' VAL . 1.4 t -49.68 -53.69 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.52 0 CA-C-N 115.807 -0.633 . . . . 0.0 112.193 -178.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.569 HG23 HD13 ' A' ' 27' ' ' LEU . 4.3 m -72.07 -38.64 64.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.678 -0.237 . . . . 0.0 111.59 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.569 HD13 HG23 ' A' ' 26' ' ' VAL . 1.9 mp -63.96 -24.85 67.88 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.906 0.384 . . . . 0.0 110.272 179.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -70.01 -30.0 67.2 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 109.287 -0.634 . . . . 0.0 109.287 178.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.96 -34.77 66.71 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.419 178.464 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.15 -40.12 78.41 Favored 'General case' 0 N--CA 1.449 -0.509 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 177.504 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.464 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.1 t -66.71 -38.63 87.13 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-N 115.086 -0.961 . . . . 0.0 110.133 179.559 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -66.52 -41.66 88.87 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 N-CA-C 109.453 -0.573 . . . . 0.0 109.453 179.173 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.94 -43.86 94.72 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.703 -0.68 . . . . 0.0 110.487 179.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.435 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.6 -49.54 75.66 Favored Glycine 0 C--N 1.333 0.368 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 178.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.607 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.36 -22.16 66.77 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.067 -0.567 . . . . 0.0 110.238 178.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.2 m-70 -75.6 -31.76 60.05 Favored 'General case' 0 CA--C 1.506 -0.746 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 179.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.569 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.25 -33.9 58.56 Favored Glycine 0 N--CA 1.437 -1.262 0 CA-C-N 114.469 -1.241 . . . . 0.0 110.946 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' HA ' ' A' ' 35' ' ' ALA . 20.0 tt -77.89 -36.57 22.29 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 120.958 -0.297 . . . . 0.0 110.512 -179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.7 -37.06 59.79 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 112.189 0.44 . . . . 0.0 112.189 -179.252 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.71 -38.82 77.09 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-O 120.87 0.367 . . . . 0.0 111.017 -178.927 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.623 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -77.6 -32.5 53.64 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.991 -0.549 . . . . 0.0 110.619 179.722 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.592 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.76 -46.75 84.1 Favored 'General case' 0 N--CA 1.444 -0.749 0 N-CA-C 108.433 -0.951 . . . . 0.0 108.433 176.12 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 91.9 t -69.9 -54.16 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.661 0 CA-C-N 114.949 -1.023 . . . . 0.0 112.035 -179.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 4.3 m-85 -76.23 -54.93 6.08 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.96 1.837 . . . . 0.0 115.96 -177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -38.15 64.24 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 113.679 -1.601 . . . . 0.0 114.447 -175.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.489 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 7.4 t -70.57 16.03 0.09 Allowed 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.849 -178.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.526 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -50.18 156.59 0.78 Allowed 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 178.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.471 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.85 8.79 0.04 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -178.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.526 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.83 -25.84 19.7 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.82 0.343 . . . . 0.0 110.659 178.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.56 -23.22 63.53 Favored 'General case' 0 CA--C 1.531 0.218 0 CA-C-N 116.074 -0.512 . . . . 0.0 111.616 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 48' ' ' ALA . 30.7 pt -70.03 -29.26 39.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-O 120.702 0.287 . . . . 0.0 111.022 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -54.71 -29.91 54.57 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.253 -0.431 . . . . 0.0 110.665 179.656 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 149.52 30.99 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.749 -0.739 . . . . 0.0 113.138 179.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.448 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.0 ttm180 -122.52 98.77 6.07 Favored 'General case' 0 N--CA 1.452 -0.344 0 CA-C-O 121.825 0.821 . . . . 0.0 110.577 179.741 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -75.13 -18.87 60.14 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.337 -0.847 . . . . 0.0 111.404 179.219 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.611 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.9 -54.49 0.19 Allowed Pre-proline 0 CA--C 1.536 0.436 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -178.286 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 79.8 Cg_exo -49.09 -45.09 30.74 Favored 'Trans proline' 0 C--N 1.354 0.829 0 C-N-CA 121.492 1.462 . . . . 0.0 112.027 178.944 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.457 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.53 -47.26 45.17 Favored Glycine 0 CA--C 1.506 -0.524 0 CA-C-N 115.815 -0.63 . . . . 0.0 113.345 179.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.39 -39.57 94.87 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 114.945 -0.627 . . . . 0.0 111.496 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.623 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.96 -35.13 79.13 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.085 0.469 . . . . 0.0 110.238 179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.592 ' CE1' HD12 ' A' ' 42' ' ' LEU . 3.1 m-30 -73.15 -43.81 60.99 Favored 'General case' 0 CA--C 1.512 -0.488 0 CA-C-N 115.662 -0.699 . . . . 0.0 109.863 179.133 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.7 -39.44 84.39 Favored 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.188 -0.915 . . . . 0.0 111.007 -179.812 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.3 m-85 -71.01 -54.64 10.51 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.828 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.1 m-85 -77.76 -24.06 49.1 Favored 'General case' 0 C--O 1.222 -0.358 0 N-CA-C 111.738 0.273 . . . . 0.0 111.738 -179.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.36 45.7 Favored Glycine 0 CA--C 1.519 0.29 0 C-N-CA 120.056 -1.069 . . . . 0.0 111.721 179.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 2.0 p -91.13 -27.51 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.461 0.109 0 N-CA-C 109.136 -0.691 . . . . 0.0 109.136 178.351 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.43 -50.57 75.76 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-N 114.863 -1.062 . . . . 0.0 111.114 178.841 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.828 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 49.6 Cg_endo -64.96 -40.51 20.49 Favored 'Trans proline' 0 N--CA 1.448 -1.156 0 C-N-CA 123.112 2.541 . . . . 0.0 112.155 -178.096 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -58.0 -55.79 30.4 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.344 -0.389 . . . . 0.0 110.107 179.695 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 96.5 mt -57.03 -52.61 64.59 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.223 179.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 71.7 mt -49.63 -53.64 22.98 Favored 'General case' 0 N--CA 1.464 0.233 0 O-C-N 123.362 0.414 . . . . 0.0 112.073 -179.339 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.452 HD12 HD23 ' A' ' 27' ' ' LEU . 40.2 tp -57.59 -44.7 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 N-CA-C 111.688 0.255 . . . . 0.0 111.688 -179.535 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 9.5 tt -68.45 -39.67 81.38 Favored 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 112.649 0.611 . . . . 0.0 112.649 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.3 pp -82.65 -20.15 36.86 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.012 0.434 . . . . 0.0 110.214 179.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.496 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.15 -9.51 42.16 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.523 178.422 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.642 HD12 ' HD2' ' A' ' 77' ' ' PRO . 17.5 tp -97.75 133.46 23.42 Favored Pre-proline 0 CA--C 1.532 0.271 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.114 179.478 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.642 ' HD2' HD12 ' A' ' 76' ' ' LEU . 91.4 Cg_exo -44.79 148.02 1.63 Allowed 'Trans proline' 0 C--N 1.353 0.782 0 C-N-CA 122.577 2.185 . . . . 0.0 112.517 -179.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.52 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 14.6 Cg_endo -56.6 -48.31 19.51 Favored 'Trans proline' 0 C--N 1.349 0.579 0 C-N-CA 122.559 2.173 . . . . 0.0 112.859 -179.395 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 27.7 mmt180 -61.21 -29.27 69.72 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.863 0.363 . . . . 0.0 110.885 -179.816 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.498 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.0 -50.44 16.56 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.127 -0.488 . . . . 0.0 112.068 -179.371 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.52 ' HD2' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -72.93 -23.27 60.67 Favored 'General case' 0 C--N 1.331 -0.204 0 C-N-CA 120.983 -0.287 . . . . 0.0 110.979 -179.163 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.28 -43.4 64.3 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 120.825 0.345 . . . . 0.0 110.869 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.95 -16.35 63.19 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.002 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -89.12 -13.03 39.42 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.919 179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -82.48 140.44 33.37 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.147 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 51.8 m . . . . . 0 C--O 1.249 1.061 0 CA-C-O 118.132 -0.937 . . . . 0.0 110.886 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.3 Cg_endo . . . . . 0 N--CA 1.484 0.953 0 N-CA-C 111.017 -0.416 . . . . 0.0 111.017 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 66.4 tp -71.83 -24.37 61.69 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.495 . . . . 0.0 111.162 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.69 -33.49 60.49 Favored Glycine 0 CA--C 1.519 0.335 0 C-N-CA 121.012 -0.613 . . . . 0.0 113.432 -179.445 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.456 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 48.1 t -56.15 -51.16 82.92 Favored Pre-proline 0 CA--C 1.537 0.445 0 N-CA-C 112.379 0.511 . . . . 0.0 112.379 -178.911 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.456 ' HD2' ' N ' ' A' ' 5' ' ' SER . 57.0 Cg_endo -71.26 -34.64 9.65 Favored 'Trans proline' 0 C--N 1.351 0.674 0 C-N-CA 122.031 1.821 . . . . 0.0 112.568 -179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -60.31 -38.82 84.87 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.81 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 81.7 t80 -71.54 -35.47 70.66 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.85 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.91 -34.91 74.12 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.089 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.55 -48.85 45.9 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.427 -179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 91.6 mtp -59.89 -43.62 94.68 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.32 -0.4 . . . . 0.0 111.123 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -58.99 -37.22 76.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.758 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 87.0 t80 -60.02 -51.2 70.67 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.033 -0.53 . . . . 0.0 110.954 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 46.9 mmtm -60.2 -36.71 78.25 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.027 179.994 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.2 t70 -66.34 -37.73 86.0 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.688 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -67.55 -45.13 76.55 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.112 -0.494 . . . . 0.0 110.9 179.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -67.93 -31.95 72.06 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.015 -179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.577 ' HA ' HD23 ' A' ' 21' ' ' LEU . 15.6 t70 -67.96 -49.54 61.11 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.815 179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -62.57 -28.59 69.98 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.719 179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.98 -49.16 66.24 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.472 -179.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.72 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.1 pp -62.4 -44.13 97.17 Favored 'General case' 0 C--O 1.219 -0.501 0 N-CA-C 111.678 0.251 . . . . 0.0 111.678 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.68 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 11.9 pt-20 -68.44 -37.58 80.38 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.795 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.656 HD22 ' HG3' ' A' ' 22' ' ' GLU . 0.9 OUTLIER -66.15 -55.02 18.42 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.857 -0.337 . . . . 0.0 110.973 -179.759 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 11.7 tp -52.23 -52.0 55.0 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -179.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.72 HG13 ' O ' ' A' ' 21' ' ' LEU . 18.8 m -52.34 -44.49 42.91 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.476 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 -177.442 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 53.0 t -75.46 -41.18 42.36 Favored 'Isoleucine or valine' 0 C--O 1.232 0.144 0 CA-C-O 120.796 0.332 . . . . 0.0 110.993 179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.61 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 87.2 mt -63.7 -22.43 66.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.412 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -69.65 -30.39 68.08 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 178.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.736 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.44 -33.63 65.02 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.285 -0.87 . . . . 0.0 109.442 178.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.12 -42.03 76.58 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 34.6 t -65.53 -41.08 93.47 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-N 115.112 -0.949 . . . . 0.0 110.06 179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.736 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.65 -38.89 83.47 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.311 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 178.966 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.61 -41.75 97.9 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.277 178.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.47 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.11 -49.65 72.93 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.747 -0.941 . . . . 0.0 110.747 178.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.47 -21.21 66.19 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 114.926 -0.637 . . . . 0.0 110.254 178.359 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.464 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.4 m-70 -75.59 -31.75 60.08 Favored 'General case' 0 CA--C 1.5 -0.957 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 179.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.28 -32.95 57.51 Favored Glycine 0 N--CA 1.431 -1.637 0 CA-C-N 114.239 -1.346 . . . . 0.0 110.861 178.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.591 ' O ' HD13 ' A' ' 42' ' ' LEU . 14.0 tt -77.92 -36.08 21.56 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 120.812 -0.355 . . . . 0.0 110.335 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.808 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.85 -35.97 57.12 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 120.755 -0.378 . . . . 0.0 111.989 -179.345 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.808 ' N ' HD12 ' A' ' 39' ' ' LEU . 32.8 p -70.83 -38.14 73.23 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-O 121.071 0.462 . . . . 0.0 110.537 -179.637 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.628 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 16.4 m-85 -76.01 -35.24 59.62 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.389 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.591 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.5 mp -56.21 -45.49 79.84 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-O 121.941 0.877 . . . . 0.0 108.763 176.603 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 39' ' ' LEU . 93.4 t -70.98 -48.22 57.32 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.714 0 CA-C-N 114.879 -1.055 . . . . 0.0 112.097 -179.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -75.77 -53.84 7.87 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -177.804 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.681 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.4 m-85 -78.82 -48.71 14.24 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 -176.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.485 ' HB3' ' O ' ' A' ' 42' ' ' LEU . 29.4 t -52.5 -81.36 0.01 OUTLIER 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 120.029 -0.669 . . . . 0.0 111.913 -175.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 44.73 -143.16 0.19 Allowed 'General case' 0 C--N 1.331 -0.212 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 -179.167 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.41 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.74 12.18 9.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.976 0.417 . . . . 0.0 110.846 178.964 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 30.9 m95 -91.13 -28.64 17.76 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.055 -0.52 . . . . 0.0 111.208 179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.519 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.26 -28.22 66.12 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.527 -179.18 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.41 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.9 pt -65.06 -28.9 45.82 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-O 120.792 0.329 . . . . 0.0 111.067 179.954 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -54.56 -32.01 57.64 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.034 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 150.57 44.88 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.262 0 C-N-CA 120.697 -0.764 . . . . 0.0 112.608 179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.491 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -141.78 100.96 3.86 Favored 'General case' 0 CA--C 1.536 0.434 0 CA-C-O 121.644 0.735 . . . . 0.0 110.664 179.939 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.458 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.85 -20.03 58.43 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.249 178.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.66 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.96 -54.03 0.19 Allowed Pre-proline 0 N--CA 1.469 0.493 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 -178.443 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.681 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.6 Cg_exo -50.14 -47.89 22.08 Favored 'Trans proline' 0 C--N 1.352 0.724 0 C-N-CA 121.694 1.596 . . . . 0.0 111.94 179.108 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.458 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.58 -48.03 29.02 Favored Glycine 0 CA--C 1.507 -0.436 0 CA-C-N 115.747 -0.661 . . . . 0.0 113.721 179.469 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.91 -42.86 97.31 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 115.134 -0.533 . . . . 0.0 111.794 -179.069 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.628 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.72 -34.7 73.26 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.304 0.573 . . . . 0.0 110.153 179.146 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.634 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -74.1 -46.24 44.01 Favored 'General case' 0 CA--C 1.511 -0.525 0 CA-C-N 115.209 -0.905 . . . . 0.0 109.969 179.39 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.39 -38.98 92.92 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.299 -0.864 . . . . 0.0 110.632 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.34 -54.77 9.66 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 112.841 0.682 . . . . 0.0 112.841 -178.639 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.836 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.67 -24.31 49.39 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 111.795 0.294 . . . . 0.0 111.795 -179.737 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.7 -32.15 42.28 Favored Glycine 0 N--CA 1.453 -0.228 0 C-N-CA 120.199 -1.001 . . . . 0.0 111.493 179.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.21 -26.11 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.523 -0.09 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 178.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -51.12 -51.0 72.15 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 114.843 -1.071 . . . . 0.0 110.942 178.707 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.836 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.0 Cg_endo -64.44 -40.14 25.67 Favored 'Trans proline' 0 N--CA 1.445 -1.354 0 C-N-CA 122.841 2.36 . . . . 0.0 112.132 -178.352 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -57.92 -56.22 24.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.955 0.407 . . . . 0.0 110.342 179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.403 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.0 mt -57.44 -54.15 50.13 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.426 179.839 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 89.4 mt -48.88 -50.95 32.46 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.395 0.434 . . . . 0.0 112.011 -179.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 2.4 tt -59.21 -50.57 73.51 Favored 'General case' 0 C--O 1.22 -0.491 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.655 -179.307 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.451 HD13 ' CD2' ' A' ' 81' ' ' TYR . 12.3 tp -64.57 -37.71 88.51 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.688 0.625 . . . . 0.0 112.688 -178.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 2.0 pp -81.6 -24.34 36.5 Favored 'General case' 0 C--N 1.33 -0.252 0 C-N-CA 120.6 -0.44 . . . . 0.0 110.377 179.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.51 -7.63 52.46 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-O 121.369 0.604 . . . . 0.0 109.525 178.284 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.654 HD22 ' HD2' ' A' ' 77' ' ' PRO . 2.4 tm? -114.46 127.02 27.24 Favored Pre-proline 0 CA--C 1.532 0.275 0 CA-C-N 114.582 -1.19 . . . . 0.0 109.496 179.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.654 ' HD2' HD22 ' A' ' 76' ' ' LEU . 60.4 Cg_exo -38.43 118.57 0.34 Allowed 'Trans proline' 0 C--N 1.351 0.683 0 C-N-CA 122.59 2.193 . . . . 0.0 112.432 179.855 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -48.05 -37.69 30.6 Favored 'Trans proline' 0 C--N 1.353 0.781 0 C-N-CA 122.988 2.459 . . . . 0.0 113.223 -179.466 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 20.2 tpp180 -68.35 -32.27 72.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.756 0.312 . . . . 0.0 110.934 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.461 ' HB3' ' CD1' ' A' ' 76' ' ' LEU . . . -76.01 -45.39 34.75 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.47 -179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.503 ' HB2' HD12 ' A' ' 76' ' ' LEU . 3.9 t80 -70.41 -33.05 70.92 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 120.66 0.267 . . . . 0.0 111.088 -179.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.54 -36.79 71.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.879 0.371 . . . . 0.0 110.723 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.72 -22.92 64.31 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.95 179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -82.73 -3.42 56.47 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.052 179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -88.5 145.15 25.91 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.132 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.1 t . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.254 -0.879 . . . . 0.0 110.904 -179.974 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo . . . . . 0 N--CA 1.485 0.988 0 N-CA-C 111.115 -0.379 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.451 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 90.2 mt -71.26 -18.81 62.42 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.131 -179.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.14 -35.65 57.09 Favored Glycine 0 CA--C 1.521 0.415 0 C-N-CA 121.016 -0.612 . . . . 0.0 113.466 -179.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.604 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 53.0 m -55.57 -50.73 85.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 N-CA-C 112.37 0.507 . . . . 0.0 112.37 -178.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.604 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 51.5 Cg_exo -55.72 -28.74 68.0 Favored 'Trans proline' 0 C--N 1.352 0.743 0 C-N-CA 122.122 1.881 . . . . 0.0 112.751 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -64.29 -46.6 82.89 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.706 0.288 . . . . 0.0 111.155 -179.783 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 97.8 m-85 -67.34 -36.99 82.54 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.34 -0.391 . . . . 0.0 110.892 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.08 -42.58 84.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.881 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -62.61 -43.41 98.88 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.053 -0.521 . . . . 0.0 110.989 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.0 ttt -62.87 -34.28 77.05 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.636 179.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -62.06 -42.56 99.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.004 -0.544 . . . . 0.0 110.984 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 57.2 m-85 -63.63 -33.76 76.33 Favored 'General case' 0 C--N 1.332 -0.193 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.134 179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -69.8 -52.64 23.42 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.062 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -61.09 -32.26 71.93 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.151 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.3 t70 -70.93 -31.53 68.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.857 179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.4 t70 -77.41 -43.66 31.84 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.061 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -65.98 -34.43 78.08 Favored 'General case' 0 C--N 1.331 -0.221 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.283 -179.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 57.3 tptt -68.23 -48.91 63.85 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.375 -0.375 . . . . 0.0 111.226 -179.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -60.68 -49.18 78.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.338 -179.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.479 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.01 -46.46 75.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.11 -0.496 . . . . 0.0 111.546 -179.74 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.479 ' N ' HD23 ' A' ' 21' ' ' LEU . 0.0 OUTLIER -66.75 -37.11 83.99 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 120.677 0.275 . . . . 0.0 111.099 -179.008 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 95.2 m-20 -63.13 -38.76 92.44 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.939 0.399 . . . . 0.0 110.613 179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.3 mp -59.51 -53.65 55.62 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.022 -0.535 . . . . 0.0 111.454 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 21' ' ' LEU . 23.1 t -51.44 -48.22 34.77 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 CA-C-N 115.507 -0.769 . . . . 0.0 112.494 -178.514 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.567 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -73.32 -36.2 48.46 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.204 0 CA-C-O 120.656 0.265 . . . . 0.0 111.074 -179.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.567 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -65.92 -24.01 66.74 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.862 0.363 . . . . 0.0 110.034 179.301 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -69.38 -30.6 68.63 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 178.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.731 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.32 -33.69 65.28 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 115.59 -0.732 . . . . 0.0 109.463 178.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.2 -43.47 74.07 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-O 121.452 0.644 . . . . 0.0 109.346 177.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 72.1 m -65.23 -40.61 94.3 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 114.976 -1.011 . . . . 0.0 110.318 179.755 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.731 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.1 p -63.08 -39.62 85.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.307 0 N-CA-C 109.163 -0.681 . . . . 0.0 109.163 178.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.5 -41.45 97.3 Favored 'General case' 0 N--CA 1.456 -0.15 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.381 178.831 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.456 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.17 -49.74 71.9 Favored Glycine 0 C--N 1.333 0.375 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 178.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.625 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.75 -20.18 65.2 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.157 -0.522 . . . . 0.0 110.176 178.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 5.5 m-70 -75.72 -33.21 60.29 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.623 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.33 -32.91 59.48 Favored Glycine 0 N--CA 1.43 -1.748 0 CA-C-N 114.009 -1.45 . . . . 0.0 110.43 178.595 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.642 ' O ' HD13 ' A' ' 42' ' ' LEU . 12.4 tt -77.46 -36.63 23.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 C-N-CA 121.054 -0.258 . . . . 0.0 110.527 -179.88 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.865 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.93 -38.85 57.23 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.036 0.384 . . . . 0.0 112.036 -179.26 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.865 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -71.19 -36.17 71.83 Favored 'General case' 0 CA--C 1.511 -0.533 0 C-N-CA 120.832 -0.347 . . . . 0.0 110.981 -179.097 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 13.1 m-85 -76.1 -35.93 59.11 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.121 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.642 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.8 mp -56.05 -44.83 79.23 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 108.651 -0.87 . . . . 0.0 108.651 176.585 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 39' ' ' LEU . 92.1 t -70.91 -48.28 57.45 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 114.941 -1.027 . . . . 0.0 112.048 -179.391 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -75.48 -53.77 8.12 Favored 'General case' 0 CA--C 1.55 0.976 0 N-CA-C 115.34 1.607 . . . . 0.0 115.34 -177.87 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.742 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 10.8 m-85 -79.23 -47.72 15.46 Favored 'General case' 0 N--CA 1.474 0.77 0 N-CA-C 115.009 1.485 . . . . 0.0 115.009 -176.543 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.545 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 9.2 t -60.78 -0.53 0.29 Allowed 'General case' 0 C--N 1.321 -0.649 0 C-N-CA 120.06 -0.656 . . . . 0.0 112.549 -175.509 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.521 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -46.9 161.18 0.07 Allowed 'General case' 0 C--N 1.334 -0.092 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 178.829 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -62.77 10.9 0.03 OUTLIER 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 112.193 0.442 . . . . 0.0 112.193 -178.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.521 ' H ' ' C ' ' A' ' 47' ' ' ALA . 39.3 m95 -90.29 -26.3 20.08 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 120.778 0.323 . . . . 0.0 110.532 178.537 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.52 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 0.8 OUTLIER -69.48 -33.1 72.38 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.219 -179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 49.6 pt -59.56 -27.7 38.14 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.232 0 CA-C-O 120.899 0.38 . . . . 0.0 110.687 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.0 tptp -53.27 -42.39 66.49 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.087 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 161.89 48.62 0.02 OUTLIER Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.053 -1.07 . . . . 0.0 113.52 179.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.552 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 13.4 ptp180 -154.88 107.13 2.72 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.741 0.782 . . . . 0.0 111.708 178.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.459 ' C ' ' HD2' ' A' ' 57' ' ' PRO . 4.4 pp -74.12 -16.84 61.0 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.618 178.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.587 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -23.99 -51.52 0.12 Allowed Pre-proline 0 N--CA 1.467 0.384 0 N-CA-C 113.037 0.754 . . . . 0.0 113.037 -178.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.742 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 82.3 Cg_exo -47.39 -49.96 12.14 Favored 'Trans proline' 0 C--N 1.352 0.711 0 C-N-CA 121.379 1.386 . . . . 0.0 111.823 178.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . -48.39 -48.07 27.84 Favored Glycine 0 CA--C 1.509 -0.307 0 CA-C-N 115.879 -0.6 . . . . 0.0 113.905 179.546 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.0 -42.27 97.23 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.141 -0.529 . . . . 0.0 112.049 -178.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.572 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -61.79 -32.62 72.92 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.189 0.519 . . . . 0.0 110.126 179.164 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.648 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -75.45 -45.03 41.13 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-N 115.36 -0.836 . . . . 0.0 110.179 179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.96 -37.05 83.55 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.418 -0.81 . . . . 0.0 110.468 179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.693 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 23.5 t80 -71.19 -54.54 10.62 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.075 -0.512 . . . . 0.0 112.29 -179.175 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.62 -23.77 49.73 Favored 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 111.937 0.347 . . . . 0.0 111.937 -179.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.488 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.02 -29.19 47.39 Favored Glycine 0 CA--C 1.518 0.246 0 C-N-CA 120.076 -1.059 . . . . 0.0 111.614 179.367 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -90.94 -29.08 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.278 0 N-CA-C 108.925 -0.769 . . . . 0.0 108.925 178.1 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.693 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.81 -50.44 73.83 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 114.772 -1.104 . . . . 0.0 110.978 179.183 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.6 Cg_endo -63.84 -39.57 32.89 Favored 'Trans proline' 0 N--CA 1.449 -1.131 0 C-N-CA 122.933 2.422 . . . . 0.0 111.902 -178.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -57.1 -58.24 9.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.177 -0.465 . . . . 0.0 109.918 179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.3 mp -56.62 -51.51 68.39 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.852 -0.613 . . . . 0.0 111.32 179.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 66.2 mt -49.33 -52.64 26.64 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.21 0.448 . . . . 0.0 112.21 -179.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.43 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 47.6 tp -59.31 -44.25 92.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.827 0.306 . . . . 0.0 111.827 -179.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.404 HD12 ' HB2' ' A' ' 81' ' ' TYR . 11.4 tp -70.34 -39.08 74.9 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.9 0.704 . . . . 0.0 112.9 -178.371 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.91 -25.79 34.65 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.005 0.431 . . . . 0.0 110.411 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.531 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -85.79 -8.55 58.05 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 178.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.697 HD12 ' HD2' ' A' ' 77' ' ' PRO . 33.8 tp -94.89 127.91 41.34 Favored Pre-proline 0 CA--C 1.534 0.329 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.777 179.215 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.697 ' HD2' HD12 ' A' ' 76' ' ' LEU . 79.0 Cg_exo -41.44 151.63 0.14 Allowed 'Trans proline' 0 C--N 1.355 0.902 0 C-N-CA 122.931 2.421 . . . . 0.0 113.272 -179.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.495 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 53.2 Cg_exo -54.77 -55.49 3.22 Favored 'Trans proline' 0 C--N 1.348 0.546 0 C-N-CA 122.55 2.167 . . . . 0.0 113.222 -179.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 31.7 mmm180 -61.73 -27.57 68.81 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.828 0.346 . . . . 0.0 111.111 -179.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.04 -46.27 36.04 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.929 -179.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.495 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -76.89 -27.17 54.88 Favored 'General case' 0 C--N 1.333 -0.129 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.063 -178.936 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.27 -44.01 66.07 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.89 0.376 . . . . 0.0 110.661 179.78 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.68 -17.02 63.46 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.065 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -85.28 -12.93 51.28 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.101 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.12 163.24 18.89 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.192 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.5 t . . . . . 0 C--O 1.248 0.991 0 CA-C-O 118.161 -0.923 . . . . 0.0 111.111 179.892 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 6.7 Cg_exo . . . . . 0 N--CA 1.485 0.987 0 N-CA-C 111.166 -0.359 . . . . 0.0 111.166 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 3.8 mm? -69.11 -18.0 63.92 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.159 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.81 -33.73 59.92 Favored Glycine 0 CA--C 1.52 0.349 0 C-N-CA 121.027 -0.606 . . . . 0.0 113.439 -179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.608 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 42.4 t -56.96 -50.86 85.76 Favored Pre-proline 0 CA--C 1.535 0.366 0 N-CA-C 112.135 0.421 . . . . 0.0 112.135 -179.145 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 45.3 Cg_exo -56.41 -28.62 73.84 Favored 'Trans proline' 0 C--N 1.352 0.731 0 C-N-CA 122.069 1.846 . . . . 0.0 112.466 179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -58.1 -50.35 73.78 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.359 -0.382 . . . . 0.0 111.12 -179.832 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 88.9 m-85 -64.19 -36.47 84.18 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.276 -0.42 . . . . 0.0 111.124 -179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.25 -32.7 73.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.301 -0.409 . . . . 0.0 111.367 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -75.57 -36.79 60.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.27 -0.423 . . . . 0.0 111.082 -179.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 85.9 mtp -70.54 -35.66 73.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.167 -0.469 . . . . 0.0 110.828 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -65.23 -35.71 81.89 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.789 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.5 t80 -67.03 -36.34 81.88 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.21 -0.45 . . . . 0.0 110.387 179.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -66.46 -50.23 64.04 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.607 179.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -59.96 -41.33 91.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.865 179.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -62.53 -32.62 73.6 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.492 . . . . 0.0 110.588 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.26 -41.71 60.82 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.675 179.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 57.6 m-20 -66.43 -31.39 72.12 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.721 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -72.53 -35.68 68.13 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.246 -0.434 . . . . 0.0 110.724 179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.19 -48.22 68.58 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 0.0 110.847 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.433 ' O ' HG22 ' A' ' 25' ' ' VAL . 0.0 OUTLIER -57.68 -49.5 76.28 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.574 -179.833 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -63.5 -35.7 81.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.666 0.269 . . . . 0.0 111.567 -178.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.481 ' O ' HD13 ' A' ' 27' ' ' LEU . 11.0 m120 -65.87 -42.51 90.25 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.787 0.327 . . . . 0.0 111.012 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.0 mp -60.08 -55.74 30.24 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 112.361 0.504 . . . . 0.0 112.361 -179.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.433 HG22 ' O ' ' A' ' 21' ' ' LEU . 2.3 m -52.81 -43.91 46.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.138 -0.483 . . . . 0.0 112.295 -178.123 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 58.4 t -72.1 -41.59 67.51 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.807 0.337 . . . . 0.0 110.946 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' HB3' HD23 ' A' ' 72' ' ' LEU . 0.6 OUTLIER -64.67 -22.93 67.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.2 -0.455 . . . . 0.0 110.508 179.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -69.31 -34.25 74.38 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 109.432 -0.581 . . . . 0.0 109.432 178.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.713 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.16 65.71 Favored 'General case' 0 N--CA 1.453 -0.305 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.723 178.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -44.69 71.4 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 121.286 0.565 . . . . 0.0 109.601 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.424 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 43.2 t -64.37 -39.6 94.2 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.212 179.551 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -64.5 -40.76 90.18 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 N-CA-C 109.314 -0.625 . . . . 0.0 109.314 179.246 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.39 -42.31 95.64 Favored 'General case' 0 C--N 1.333 -0.144 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.338 178.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.44 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.93 -49.36 76.39 Favored Glycine 0 C--N 1.332 0.323 0 N-CA-C 110.916 -0.874 . . . . 0.0 110.916 178.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.609 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -66.01 -21.35 66.39 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 115.036 -0.582 . . . . 0.0 110.254 178.441 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.467 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 10.1 m-70 -75.96 -33.28 59.79 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 179.195 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.589 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.82 -33.42 60.17 Favored Glycine 0 N--CA 1.435 -1.384 0 CA-C-N 114.324 -1.307 . . . . 0.0 110.924 179.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.609 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.9 tt -77.78 -36.77 22.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.19 0 C-N-CA 120.986 -0.286 . . . . 0.0 110.479 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.886 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.49 -37.95 59.85 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.353 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.886 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.19 -38.47 78.65 Favored 'General case' 0 CA--C 1.511 -0.554 0 CA-C-O 120.75 0.309 . . . . 0.0 111.016 -178.778 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.559 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.0 m-85 -77.9 -32.78 51.94 Favored 'General case' 0 C--N 1.317 -0.821 0 CA-C-N 116.152 -0.476 . . . . 0.0 110.459 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.523 HD12 ' CE1' ' A' ' 61' ' ' TYR . 0.9 OUTLIER -57.68 -46.99 83.56 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-O 122.024 0.916 . . . . 0.0 108.674 176.399 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.413 HG23 ' O ' ' A' ' 39' ' ' LEU . 90.6 t -70.15 -53.92 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.676 0 CA-C-N 114.828 -1.078 . . . . 0.0 112.007 -179.226 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 12.3 m-85 -76.07 -54.28 7.08 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.869 1.803 . . . . 0.0 115.869 -177.611 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.519 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.31 -45.82 45.0 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.039 -1.437 . . . . 0.0 114.387 -175.331 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.547 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -61.09 -81.15 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.319 0 C-N-CA 120.467 -0.493 . . . . 0.0 111.317 -179.008 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.97 -144.83 0.35 Allowed 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 -179.046 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.443 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.11 13.49 10.48 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 120.807 0.337 . . . . 0.0 110.65 179.084 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 21.7 m95 -91.12 -35.3 14.66 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.06 -0.518 . . . . 0.0 111.011 179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 1.1 p90 -63.2 -13.69 40.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.344 -179.206 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.443 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.9 pt -67.05 -28.55 43.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.055 179.916 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 22.2 ptmt -53.82 -29.6 41.46 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.289 -0.414 . . . . 0.0 110.684 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 142.11 30.18 0.14 Allowed Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.726 -0.749 . . . . 0.0 113.069 179.737 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.474 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.7 ttm180 -117.83 99.17 6.75 Favored 'General case' 0 N--CA 1.452 -0.334 0 CA-C-O 121.674 0.75 . . . . 0.0 110.253 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.518 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -74.71 -19.89 60.07 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.59 179.644 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.604 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.22 -54.21 0.19 Allowed Pre-proline 0 N--CA 1.467 0.418 0 N-CA-C 112.912 0.708 . . . . 0.0 112.912 -178.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.604 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.0 Cg_exo -48.4 -45.83 25.33 Favored 'Trans proline' 0 C--N 1.355 0.916 0 C-N-CA 121.589 1.526 . . . . 0.0 112.032 178.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.453 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.26 -47.03 43.48 Favored Glycine 0 CA--C 1.506 -0.496 0 CA-C-N 115.792 -0.64 . . . . 0.0 113.411 179.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.07 -40.29 95.93 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.9 -0.65 . . . . 0.0 111.447 -179.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.559 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.14 -33.38 74.37 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.108 0.48 . . . . 0.0 110.228 179.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.593 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-85 -75.26 -44.2 47.18 Favored 'General case' 0 CA--C 1.511 -0.552 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.833 179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.83 -39.2 87.58 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-N 115.348 -0.842 . . . . 0.0 110.779 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.654 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.53 -54.65 9.85 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.9 OUTLIER -77.68 -24.13 49.38 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 111.906 0.336 . . . . 0.0 111.906 -179.688 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.39 -30.47 45.25 Favored Glycine 0 CA--C 1.518 0.266 0 C-N-CA 120.045 -1.074 . . . . 0.0 111.574 179.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.25 -26.74 5.02 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.16 0 N-CA-C 108.96 -0.756 . . . . 0.0 108.96 178.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.658 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.35 -50.49 75.88 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-N 114.879 -1.055 . . . . 0.0 110.829 178.657 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.7 Cg_endo -64.06 -39.64 30.82 Favored 'Trans proline' 0 N--CA 1.448 -1.181 0 C-N-CA 122.974 2.449 . . . . 0.0 111.973 -178.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -57.29 -56.27 23.95 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.195 -0.457 . . . . 0.0 110.048 179.648 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.407 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 11.1 mp -57.32 -52.81 63.86 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.923 -0.58 . . . . 0.0 111.418 179.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.2 mt -49.28 -52.9 24.62 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 -179.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.518 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 3.2 tm? -56.59 -45.17 81.55 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 111.68 0.252 . . . . 0.0 111.68 -179.325 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 57.6 mt -71.14 -39.09 72.19 Favored 'General case' 0 N--CA 1.466 0.341 0 N-CA-C 113.107 0.78 . . . . 0.0 113.107 -178.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.407 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -81.69 -21.02 38.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.969 0.414 . . . . 0.0 110.5 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.498 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -93.65 -8.99 39.45 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.88 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.572 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 5.1 tp -73.95 145.66 84.07 Favored Pre-proline 0 C--N 1.332 -0.153 0 CA-C-N 115.345 -0.843 . . . . 0.0 110.404 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.572 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 53.6 Cg_exo -52.65 161.76 2.81 Favored 'Trans proline' 0 C--N 1.349 0.558 0 C-N-CA 121.886 1.724 . . . . 0.0 111.086 178.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -57.24 -62.18 0.24 Allowed 'Trans proline' 0 C--N 1.343 0.266 0 C-N-CA 121.866 1.71 . . . . 0.0 113.347 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 35.3 mmt180 -63.03 -24.71 68.04 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.72 0.295 . . . . 0.0 111.298 -179.533 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.98 -45.05 36.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.309 -0.405 . . . . 0.0 111.546 -179.879 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.484 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -78.91 -24.43 44.1 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 120.656 -0.418 . . . . 0.0 110.583 -178.943 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.5 -43.92 65.64 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 0.0 110.419 179.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.44 -16.86 63.57 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.798 179.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.45 -16.25 56.43 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.798 179.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -86.06 171.82 11.09 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.14 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.4 m . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.319 -0.848 . . . . 0.0 110.965 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_exo . . . . . 0 N--CA 1.484 0.95 0 N-CA-C 111.224 -0.337 . . . . 0.0 111.224 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.414 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.8 mm? -71.49 -20.58 62.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.208 -0.451 . . . . 0.0 110.809 179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.07 -33.74 59.17 Favored Glycine 0 CA--C 1.519 0.303 0 C-N-CA 120.939 -0.648 . . . . 0.0 113.26 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.499 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 63.5 m -54.95 -51.04 82.72 Favored Pre-proline 0 CA--C 1.535 0.385 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -179.192 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.499 ' HD2' ' N ' ' A' ' 5' ' ' SER . 47.5 Cg_endo -68.98 -28.03 29.52 Favored 'Trans proline' 0 C--N 1.351 0.708 0 C-N-CA 122.068 1.846 . . . . 0.0 112.492 179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -57.34 -53.17 61.16 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.431 -0.349 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -66.31 -38.79 88.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.433 -0.348 . . . . 0.0 111.354 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.61 -36.69 84.64 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.885 0.374 . . . . 0.0 111.14 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -72.56 -36.93 68.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.979 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.0 tpp -65.81 -41.61 91.66 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.739 179.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -60.43 -37.73 81.87 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.728 179.874 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 89.0 t80 -62.31 -43.45 98.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.673 179.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 29.2 mtpp -62.9 -55.33 26.99 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.015 -0.538 . . . . 0.0 111.015 179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -57.45 -32.51 67.0 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.377 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -68.06 -44.07 77.21 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.402 -0.363 . . . . 0.0 110.802 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 58.8 m-20 -69.45 -33.1 72.43 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.804 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 58.3 m-20 -70.75 -37.27 73.4 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.251 -0.431 . . . . 0.0 111.165 -179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 65.4 tttm -70.95 -34.79 71.81 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.295 -0.411 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.561 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -68.72 -52.83 26.51 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.316 -0.402 . . . . 0.0 110.999 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.442 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.23 -45.19 72.26 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.496 -179.491 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.442 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.7 pt-20 -66.95 -30.98 71.26 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 120.864 0.364 . . . . 0.0 110.736 -179.686 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.48 ' O ' HD13 ' A' ' 27' ' ' LEU . 7.3 m-20 -68.0 -42.33 80.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.232 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.561 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 4.9 mt -62.78 -51.51 66.82 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.737 0.303 . . . . 0.0 111.715 -179.791 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.6 m -53.2 -45.43 54.82 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.434 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -177.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.535 HG13 HD13 ' A' ' 27' ' ' LEU . 8.3 p -74.91 -37.51 41.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.201 0 CA-C-O 120.74 0.305 . . . . 0.0 110.778 179.888 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.563 HD11 ' HB1' ' A' ' 75' ' ' ALA . 1.2 mp -64.32 -22.92 67.12 Favored 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 109.857 -0.424 . . . . 0.0 109.857 179.163 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -70.39 -31.2 68.33 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.294 178.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.726 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.14 -35.31 66.47 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.46 178.556 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.83 -38.89 80.16 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.434 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 32.9 t -66.81 -40.47 88.07 Favored 'General case' 0 N--CA 1.451 -0.404 0 CA-C-N 114.888 -1.051 . . . . 0.0 110.075 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.726 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.49 -39.24 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 179.021 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.09 -43.4 98.94 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.574 -0.739 . . . . 0.0 110.387 179.009 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.425 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.84 -49.3 77.25 Favored Glycine 0 N--CA 1.449 -0.471 0 N-CA-C 110.906 -0.878 . . . . 0.0 110.906 178.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.619 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -65.91 -21.59 66.45 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.071 -0.565 . . . . 0.0 110.284 178.342 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.45 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 8.1 m-70 -73.89 -31.9 63.33 Favored 'General case' 0 CA--C 1.502 -0.874 0 N-CA-C 107.766 -1.198 . . . . 0.0 107.766 178.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.54 -32.5 57.53 Favored Glycine 0 N--CA 1.434 -1.437 0 CA-C-N 114.086 -1.415 . . . . 0.0 111.006 178.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.619 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.6 tt -78.13 -35.97 20.75 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.198 0 C-N-CA 121.019 -0.272 . . . . 0.0 110.279 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.814 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.11 -35.43 56.38 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.062 0.394 . . . . 0.0 112.062 -179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.814 ' N ' HD12 ' A' ' 39' ' ' LEU . 34.0 p -70.22 -38.59 75.28 Favored 'General case' 0 CA--C 1.509 -0.622 0 CA-C-O 121.023 0.44 . . . . 0.0 110.969 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.658 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.9 m-85 -78.45 -34.0 48.05 Favored 'General case' 0 C--N 1.316 -0.867 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.849 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.572 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -57.04 -47.14 81.65 Favored 'General case' 0 N--CA 1.442 -0.833 0 CA-C-O 122.009 0.909 . . . . 0.0 108.711 176.267 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 39' ' ' LEU . 95.8 t -70.26 -54.39 18.86 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-N 114.914 -1.039 . . . . 0.0 112.291 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 27.3 t80 -76.4 -54.56 6.56 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 115.908 1.818 . . . . 0.0 115.908 -177.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.497 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.44 -37.49 65.83 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 113.956 -1.474 . . . . 0.0 114.422 -175.303 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.488 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.56 16.18 0.08 Allowed 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 118.089 0.404 . . . . 0.0 111.79 -179.044 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -48.69 153.47 0.81 Allowed 'General case' 0 C--N 1.331 -0.2 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.485 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -60.17 5.91 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 N-CA-C 112.268 0.47 . . . . 0.0 112.268 -178.773 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.487 ' H ' ' C ' ' A' ' 47' ' ' ALA . 55.3 m95 -90.06 -24.83 21.06 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-O 120.783 0.325 . . . . 0.0 110.688 178.966 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -69.23 -22.05 63.89 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.161 -179.637 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.485 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -69.09 -29.78 44.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-N 116.464 -0.334 . . . . 0.0 111.217 -179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -54.86 -42.88 72.56 Favored 'General case' 0 C--N 1.332 -0.166 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.628 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 164.76 30.65 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.066 179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.463 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -120.98 97.01 5.33 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-O 121.855 0.836 . . . . 0.0 110.449 179.731 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 39.4 mt -75.14 -18.91 60.12 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.182 179.129 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.608 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.89 -53.72 0.19 Allowed Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.83 0.678 . . . . 0.0 112.83 -178.544 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.608 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 81.0 Cg_exo -49.52 -45.18 32.09 Favored 'Trans proline' 0 C--N 1.355 0.876 0 C-N-CA 121.537 1.492 . . . . 0.0 112.056 178.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.38 -49.78 37.42 Favored Glycine 0 CA--C 1.505 -0.59 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.474 179.203 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.55 -38.12 88.81 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 114.871 -0.665 . . . . 0.0 111.219 -179.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.658 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.78 -36.84 84.42 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 121.157 0.503 . . . . 0.0 110.241 179.142 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.581 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.5 m-85 -72.14 -43.87 63.99 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.765 179.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.84 -39.3 87.59 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.893 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.643 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 7.7 m-85 -71.46 -55.01 8.73 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.707 0.632 . . . . 0.0 112.707 -178.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.815 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -77.81 -24.16 48.85 Favored 'General case' 0 C--O 1.222 -0.36 0 N-CA-C 111.909 0.337 . . . . 0.0 111.909 -179.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.44 -31.25 46.68 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 119.984 -1.103 . . . . 0.0 111.68 179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.7 p -91.67 -26.47 5.01 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.129 0 N-CA-C 109.123 -0.695 . . . . 0.0 109.123 178.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -50.64 -50.57 71.99 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-N 115.036 -0.984 . . . . 0.0 110.862 178.588 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.815 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 41.6 Cg_endo -64.79 -39.83 24.43 Favored 'Trans proline' 0 N--CA 1.448 -1.167 0 C-N-CA 122.978 2.452 . . . . 0.0 112.262 -178.632 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 9.5 tt -58.55 -53.43 58.38 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.983 0.42 . . . . 0.0 110.339 179.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 63.2 mt -58.53 -53.83 53.94 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.719 -0.673 . . . . 0.0 111.096 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.9 mt -49.58 -51.67 35.52 Favored 'General case' 0 C--N 1.33 -0.27 0 O-C-N 123.347 0.404 . . . . 0.0 112.089 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.543 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.1 tt -58.2 -43.9 87.82 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.758 0.281 . . . . 0.0 111.758 -179.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 78.5 mt -70.99 -39.12 72.64 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 112.871 0.693 . . . . 0.0 112.871 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -81.74 -23.2 36.85 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-O 121.037 0.446 . . . . 0.0 110.353 179.984 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.563 ' HB1' HD11 ' A' ' 27' ' ' LEU . . . -89.83 -7.14 55.02 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.848 -0.615 . . . . 0.0 109.474 178.522 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.543 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.9 tp -82.11 144.5 50.96 Favored Pre-proline 0 N--CA 1.456 -0.168 0 CA-C-N 115.155 -0.929 . . . . 0.0 110.225 179.513 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.472 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.6 Cg_exo -54.32 148.87 39.81 Favored 'Trans proline' 0 C--N 1.346 0.423 0 C-N-CA 121.882 1.722 . . . . 0.0 110.894 178.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.434 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 5.5 Cg_endo -47.85 -53.81 6.07 Favored 'Trans proline' 0 C--N 1.344 0.334 0 C-N-CA 122.135 1.89 . . . . 0.0 113.056 -178.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 9.7 mpt_? -63.75 -25.9 68.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.836 0.351 . . . . 0.0 111.151 -179.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.79 -47.21 26.71 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.676 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.434 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -76.11 -22.96 54.93 Favored 'General case' 0 C--N 1.332 -0.192 0 C-N-CA 120.762 -0.375 . . . . 0.0 110.806 -179.223 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.31 -45.34 60.41 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.807 179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.0 -15.17 63.41 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.772 179.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.39 -16.27 46.57 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.052 -0.522 . . . . 0.0 110.982 179.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.31 140.86 29.11 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.09 -0.504 . . . . 0.0 111.13 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.175 -0.917 . . . . 0.0 110.927 179.943 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo . . . . . 0 N--CA 1.483 0.905 0 N-CA-C 111.231 -0.334 . . . . 0.0 111.231 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 73.1 mt -66.15 -18.47 65.37 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.234 -0.439 . . . . 0.0 110.781 179.888 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.24 -33.52 58.98 Favored Glycine 0 CA--C 1.519 0.314 0 C-N-CA 121.049 -0.596 . . . . 0.0 113.254 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.616 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 66.4 m -56.78 -50.94 85.1 Favored Pre-proline 0 CA--C 1.535 0.37 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.616 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 32.9 Cg_exo -58.16 -29.4 87.25 Favored 'Trans proline' 0 C--N 1.353 0.78 0 C-N-CA 121.904 1.736 . . . . 0.0 112.296 179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -68.02 -47.52 68.2 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.818 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -64.95 -42.43 94.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.702 179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.91 -30.98 72.01 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.966 179.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.8 -44.14 64.47 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.049 -0.523 . . . . 0.0 111.021 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 66.0 mtt -65.8 -33.91 76.95 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.738 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -64.62 -42.3 95.61 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.579 179.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -58.66 -44.54 90.17 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 115.981 -0.554 . . . . 0.0 110.379 179.713 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -62.7 -37.38 86.28 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.235 179.453 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -66.44 -30.29 70.61 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.603 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -74.25 -32.28 62.9 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.094 -0.503 . . . . 0.0 110.665 179.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -76.24 -39.59 54.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.862 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -70.22 -31.91 69.56 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 0.0 111.08 -179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -71.49 -37.95 71.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.855 -179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.49 -40.72 85.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.017 -179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.45 -49.2 74.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.057 -0.519 . . . . 0.0 111.806 -179.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.45 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.0 pt-20 -64.44 -39.73 94.38 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.748 0.308 . . . . 0.0 111.729 -178.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.553 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 95.4 m-20 -63.2 -53.66 49.64 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.949 0.404 . . . . 0.0 110.695 -179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 8.3 mt -49.05 -56.06 10.18 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.45 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.5 m -53.09 -45.96 54.13 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -177.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.41 ' N ' HG23 ' A' ' 25' ' ' VAL . 27.8 m -74.4 -35.98 40.88 Favored 'Isoleucine or valine' 0 C--O 1.233 0.193 0 C-N-CA 120.898 -0.321 . . . . 0.0 111.146 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.553 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 91.2 mt -66.99 -23.08 65.9 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.049 0.452 . . . . 0.0 109.906 179.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -69.25 -31.02 69.28 Favored 'General case' 0 CA--C 1.519 -0.228 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 178.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.06 -31.6 64.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.214 178.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.39 -42.59 74.91 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 177.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.411 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 59.4 m -65.22 -42.18 93.71 Favored 'General case' 0 N--CA 1.448 -0.54 0 CA-C-N 114.757 -1.11 . . . . 0.0 110.241 179.76 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.4 p -62.46 -39.65 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 N-CA-C 109.18 -0.674 . . . . 0.0 109.18 178.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.6 -43.69 97.12 Favored 'General case' 0 N--CA 1.456 -0.145 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.393 178.771 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.448 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.27 -49.57 76.29 Favored Glycine 0 C--N 1.332 0.331 0 N-CA-C 111.033 -0.827 . . . . 0.0 111.033 178.876 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.576 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.05 -21.68 66.39 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.047 -0.576 . . . . 0.0 110.279 178.383 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -74.59 -32.67 62.44 Favored 'General case' 0 CA--C 1.503 -0.841 0 N-CA-C 107.872 -1.158 . . . . 0.0 107.872 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.572 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.89 59.63 Favored Glycine 0 N--CA 1.433 -1.511 0 CA-C-N 114.175 -1.375 . . . . 0.0 110.747 178.757 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.576 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.3 tt -77.45 -36.35 23.4 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.191 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.492 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.906 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.72 -38.75 58.29 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 -179.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.906 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.9 -38.35 79.55 Favored 'General case' 0 CA--C 1.51 -0.563 0 CA-C-O 120.839 0.352 . . . . 0.0 111.224 -178.793 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.656 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.3 m-85 -77.84 -34.69 51.72 Favored 'General case' 0 C--N 1.317 -0.845 0 CA-C-N 116.057 -0.52 . . . . 0.0 110.717 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.516 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.2 mp -56.67 -47.23 80.26 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-O 121.933 0.873 . . . . 0.0 108.843 176.413 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 39' ' ' LEU . 88.3 t -70.16 -54.21 19.81 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 CA-C-N 114.816 -1.083 . . . . 0.0 112.266 -179.06 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 49.3 t80 -76.88 -54.38 6.67 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.959 1.837 . . . . 0.0 115.959 -177.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.02 -45.63 56.62 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 113.951 -1.477 . . . . 0.0 114.48 -175.44 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.473 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 24.9 t -55.95 -81.01 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 120.721 -0.392 . . . . 0.0 111.477 -178.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 49.73 -147.34 0.34 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 109.73 -0.47 . . . . 0.0 109.73 -178.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.512 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.46 12.62 10.1 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 120.927 0.394 . . . . 0.0 110.824 179.043 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 44.5 m95 -91.05 -29.6 17.25 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.068 -0.515 . . . . 0.0 110.892 179.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.43 ' HB2' ' O ' ' A' ' 54' ' ' ARG . 0.9 OUTLIER -69.01 -22.31 64.08 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.518 -179.098 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.512 HG12 ' O ' ' A' ' 48' ' ' ALA . 36.7 pt -66.81 -29.7 47.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-O 120.732 0.301 . . . . 0.0 111.088 -179.873 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -54.83 -35.93 64.48 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.641 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.38 31.72 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.686 -0.769 . . . . 0.0 113.078 179.794 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.501 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.2 ttm180 -122.87 98.85 6.09 Favored 'General case' 0 N--CA 1.452 -0.347 0 CA-C-O 121.714 0.769 . . . . 0.0 110.208 179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.467 ' O ' ' N ' ' A' ' 58' ' ' GLY . 72.9 mt -75.19 -20.0 59.52 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.724 179.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.628 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.44 -54.49 0.2 Allowed Pre-proline 0 CA--C 1.537 0.443 0 N-CA-C 112.691 0.626 . . . . 0.0 112.691 -178.412 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.628 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 75.4 Cg_exo -52.02 -45.44 38.83 Favored 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 121.562 1.508 . . . . 0.0 111.972 178.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.467 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.87 -48.02 46.03 Favored Glycine 0 CA--C 1.504 -0.595 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.4 179.399 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.31 -36.94 85.76 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.967 -0.617 . . . . 0.0 111.444 -179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.656 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.66 -35.07 79.82 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.177 0.513 . . . . 0.0 109.968 179.004 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.558 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.76 -48.98 33.8 Favored 'General case' 0 CA--C 1.511 -0.536 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.086 179.214 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.89 -37.79 88.79 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.245 -0.889 . . . . 0.0 110.914 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.684 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.3 t80 -71.27 -55.42 8.09 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 112.851 0.685 . . . . 0.0 112.851 -178.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.89 -23.96 48.57 Favored 'General case' 0 C--O 1.221 -0.398 0 N-CA-C 111.735 0.272 . . . . 0.0 111.735 -179.692 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.09 -30.56 46.18 Favored Glycine 0 N--CA 1.453 -0.201 0 C-N-CA 120.174 -1.012 . . . . 0.0 111.658 179.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.44 HG22 HD23 ' A' ' 70' ' ' LEU . 1.7 p -90.26 -29.94 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.139 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 178.394 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.684 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.93 -52.44 46.73 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-N 114.68 -1.145 . . . . 0.0 111.153 179.058 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.1 Cg_endo -64.61 -40.06 24.82 Favored 'Trans proline' 0 N--CA 1.448 -1.172 0 C-N-CA 123.053 2.502 . . . . 0.0 112.441 -178.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -57.61 -56.71 18.33 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.533 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.44 HD23 HG22 ' A' ' 66' ' ' VAL . 4.5 mm? -58.61 -53.27 60.2 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 116.07 -0.513 . . . . 0.0 111.622 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 75.4 mt -49.48 -51.8 33.59 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -179.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.406 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 65.2 tp -58.28 -45.58 87.65 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -179.382 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.542 HD22 ' HB2' ' A' ' 81' ' ' TYR . 51.4 mt -69.87 -38.05 76.29 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 -178.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.9 pp -82.48 -20.0 37.7 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 121.093 0.473 . . . . 0.0 110.426 179.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -94.37 -7.24 42.24 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.767 178.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.55 HD12 ' HD2' ' A' ' 77' ' ' PRO . 15.8 tp -102.04 134.99 19.76 Favored Pre-proline 0 CA--C 1.532 0.28 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.131 179.402 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.55 ' HD2' HD12 ' A' ' 76' ' ' LEU . 90.8 Cg_exo -44.81 145.35 2.93 Favored 'Trans proline' 0 C--N 1.351 0.693 0 C-N-CA 122.573 2.182 . . . . 0.0 112.499 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.496 ' HA ' ' HD2' ' A' ' 81' ' ' TYR . 47.8 Cg_exo -55.66 -47.11 27.13 Favored 'Trans proline' 0 C--N 1.349 0.592 0 C-N-CA 122.488 2.125 . . . . 0.0 112.843 -179.47 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -65.05 -25.19 67.71 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.938 0.399 . . . . 0.0 111.011 -179.749 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.53 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.76 -48.74 20.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.363 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.542 ' HB2' HD22 ' A' ' 73' ' ' LEU . 0.3 OUTLIER -73.88 -25.82 60.23 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 120.835 0.35 . . . . 0.0 110.782 -179.393 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.83 -49.25 40.12 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.235 -0.438 . . . . 0.0 110.78 179.87 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -65.51 -17.73 64.78 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.937 179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -76.28 -26.26 55.74 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.116 179.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.3 140.07 44.66 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.304 -0.407 . . . . 0.0 111.293 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 66.4 p . . . . . 0 C--O 1.25 1.091 0 CA-C-O 118.339 -0.839 . . . . 0.0 110.891 -179.919 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_endo . . . . . 0 N--CA 1.484 0.927 0 N-CA-C 111.114 -0.379 . . . . 0.0 111.114 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 40.5 mt -71.33 -18.85 62.37 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.138 -0.483 . . . . 0.0 110.781 179.874 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.17 -33.7 58.97 Favored Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 121.091 -0.576 . . . . 0.0 113.267 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.461 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 43.3 t -52.29 -51.19 74.52 Favored Pre-proline 0 CA--C 1.534 0.331 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 -179.055 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 5' ' ' SER . 51.6 Cg_endo -69.62 -28.96 25.27 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.964 1.776 . . . . 0.0 112.444 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -64.72 -53.52 46.0 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.165 -179.825 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 89.6 t80 -64.08 -41.69 97.22 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.37 -0.377 . . . . 0.0 110.996 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.38 -36.14 81.36 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.272 -0.422 . . . . 0.0 111.31 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.27 -42.32 68.91 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.384 -179.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.0 mtp -68.33 -30.13 69.03 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.35 -179.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -68.09 -46.75 70.11 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.403 -0.362 . . . . 0.0 111.338 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.6 t80 -61.34 -37.61 83.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.295 -0.412 . . . . 0.0 110.883 -179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? -68.51 -44.69 74.12 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.887 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -62.57 -43.47 98.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.757 -179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -64.64 -28.67 69.77 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 0.0 110.452 179.814 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -74.93 -41.73 59.08 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.98 -0.555 . . . . 0.0 110.641 179.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 55.7 m-20 -67.83 -34.61 77.06 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.145 -0.48 . . . . 0.0 110.72 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -68.16 -33.58 74.73 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.514 179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.552 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -69.11 -54.26 15.93 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.048 -0.523 . . . . 0.0 111.025 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.457 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.32 -40.89 68.38 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.681 -179.469 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.457 ' N ' HD23 ' A' ' 21' ' ' LEU . 11.2 pt-20 -71.77 -32.49 67.72 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.779 0.323 . . . . 0.0 111.163 -179.278 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.584 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 84.2 m-20 -66.96 -54.49 21.44 Favored 'General case' 0 C--N 1.328 -0.368 0 C-N-CA 121.021 -0.272 . . . . 0.0 110.945 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.552 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.0 mt -53.46 -51.28 63.21 Favored 'General case' 0 C--N 1.325 -0.459 0 N-CA-C 112.116 0.413 . . . . 0.0 112.116 -179.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 27.7 m -52.77 -46.11 50.6 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.426 0 N-CA-C 112.653 0.612 . . . . 0.0 112.653 -177.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 9.6 p -75.73 -37.15 35.27 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.212 0 CA-C-O 120.849 0.357 . . . . 0.0 111.163 -179.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.584 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 97.0 mt -66.96 -22.67 65.92 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.017 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -68.54 -29.86 68.53 Favored 'General case' 0 CA--C 1.518 -0.252 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.743 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -73.56 -33.16 64.55 Favored 'General case' 0 N--CA 1.451 -0.391 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.366 178.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.26 -42.79 75.1 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 35.5 t -65.49 -40.61 93.26 Favored 'General case' 0 N--CA 1.452 -0.345 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.088 179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.743 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.25 -40.67 89.93 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.333 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 179.014 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.43 -42.57 96.33 Favored 'General case' 0 N--CA 1.456 -0.168 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.271 178.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.85 -49.6 74.23 Favored Glycine 0 C--N 1.334 0.425 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.873 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.48 -19.63 65.36 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.045 -0.577 . . . . 0.0 110.509 178.58 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.5 m-70 -77.74 -31.65 52.29 Favored 'General case' 0 CA--C 1.5 -0.953 0 N-CA-C 107.707 -1.22 . . . . 0.0 107.707 179.371 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.622 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.3 -32.14 58.43 Favored Glycine 0 N--CA 1.432 -1.573 0 CA-C-N 114.104 -1.407 . . . . 0.0 110.41 178.417 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.9 tt -78.05 -36.09 21.15 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.209 0 C-N-CA 120.831 -0.348 . . . . 0.0 110.393 179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.799 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -77.37 -35.92 54.09 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.026 0.38 . . . . 0.0 112.026 -179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.799 ' N ' HD12 ' A' ' 39' ' ' LEU . 56.4 p -71.38 -35.17 70.98 Favored 'General case' 0 CA--C 1.507 -0.676 0 CA-C-O 121.189 0.519 . . . . 0.0 110.5 -179.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 18.1 m-30 -79.49 -35.36 40.31 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.648 -0.705 . . . . 0.0 110.279 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.555 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -55.86 -46.72 78.17 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-O 121.765 0.793 . . . . 0.0 108.924 176.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.412 HG23 ' N ' ' A' ' 44' ' ' PHE . 35.0 m -72.42 -46.16 57.23 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.816 0 CA-C-N 115.087 -0.961 . . . . 0.0 112.243 -179.091 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.457 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.8 m-85 -76.59 -53.91 7.4 Favored 'General case' 0 CA--C 1.552 1.04 0 N-CA-C 115.768 1.766 . . . . 0.0 115.768 -178.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.716 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 9.3 m-85 -77.84 -48.7 15.86 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 115.296 1.591 . . . . 0.0 115.296 -176.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.493 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 34.0 t -54.44 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.76 0 C-N-CA 120.003 -0.679 . . . . 0.0 112.233 -174.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 45.79 -145.71 0.17 Allowed 'General case' 0 C--N 1.331 -0.217 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 -178.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.452 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.73 8.31 9.44 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 120.941 0.401 . . . . 0.0 110.496 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 35.9 m95 -91.28 -26.76 18.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.912 -0.585 . . . . 0.0 111.82 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.596 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.4 p90 -63.8 -34.12 77.2 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.552 -0.295 . . . . 0.0 111.568 -178.928 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 48' ' ' ALA . 40.4 pt -56.49 -26.97 23.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.355 -0.384 . . . . 0.0 111.445 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 29.9 mmtp -52.48 -48.73 65.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.235 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 173.15 49.76 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.096 -1.05 . . . . 0.0 113.073 179.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.566 ' O ' ' HG3' ' A' ' 54' ' ' ARG . 18.8 ptt180 -156.21 102.02 2.1 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.535 0.683 . . . . 0.0 111.856 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' C ' ' A' ' 56' ' ' ALA . 38.7 mt -73.91 -18.23 60.93 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.207 178.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.633 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.23 -53.79 0.17 Allowed Pre-proline 0 N--CA 1.463 0.224 0 O-C-N 123.691 0.619 . . . . 0.0 112.388 -178.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.716 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 83.7 Cg_exo -47.61 -51.12 10.22 Favored 'Trans proline' 0 C--N 1.353 0.779 0 C-N-CA 121.271 1.314 . . . . 0.0 111.87 178.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.62 -50.0 26.08 Favored Glycine 0 CA--C 1.507 -0.44 0 CA-C-N 115.858 -0.61 . . . . 0.0 113.694 179.613 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.51 -40.83 96.37 Favored 'General case' 0 C--N 1.312 -1.043 0 CA-C-N 115.191 -0.504 . . . . 0.0 111.847 -178.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -60.42 -34.08 73.44 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.309 0.576 . . . . 0.0 110.01 179.052 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.65 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.4 m-30 -75.03 -51.62 13.12 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.523 179.618 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -61.35 -36.32 79.87 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.589 179.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.705 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 24.3 t80 -71.29 -55.28 8.36 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.533 -178.807 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.824 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.4 OUTLIER -77.71 -23.82 49.37 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -179.602 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -80.27 -29.78 44.0 Favored Glycine 0 N--CA 1.454 -0.142 0 C-N-CA 120.222 -0.99 . . . . 0.0 111.616 179.665 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.29 -30.29 5.0 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.232 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 178.216 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.705 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.69 -51.29 61.1 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-N 114.728 -1.124 . . . . 0.0 111.314 179.208 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.824 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 48.2 Cg_endo -64.94 -39.75 23.57 Favored 'Trans proline' 0 N--CA 1.447 -1.249 0 C-N-CA 122.814 2.343 . . . . 0.0 111.992 -178.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 73' ' ' LEU . 1.5 tm? -57.56 -57.51 12.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.123 179.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.406 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 4.4 mm? -57.09 -52.03 66.92 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 116.189 -0.459 . . . . 0.0 111.432 179.814 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.03 -50.96 45.79 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 111.956 0.354 . . . . 0.0 111.956 -179.179 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.425 HD13 ' C ' ' A' ' 72' ' ' LEU . 3.2 tm? -58.28 -45.57 87.67 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.71 -0.223 . . . . 0.0 111.533 -179.377 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.493 HD13 HD13 ' A' ' 69' ' ' LEU . 10.8 mp -71.34 -37.88 71.68 Favored 'General case' 0 N--CA 1.467 0.417 0 N-CA-C 112.996 0.739 . . . . 0.0 112.996 -178.492 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.406 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.8 pp -81.48 -23.58 37.29 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.01 0.433 . . . . 0.0 110.263 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -90.0 -6.04 56.02 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.336 0.589 . . . . 0.0 109.613 178.475 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.685 HD12 ' HD2' ' A' ' 77' ' ' PRO . 15.8 tp -101.73 133.07 20.99 Favored Pre-proline 0 CA--C 1.53 0.174 0 CA-C-N 114.909 -1.041 . . . . 0.0 110.003 179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.685 ' HD2' HD12 ' A' ' 76' ' ' LEU . 69.7 Cg_exo -41.54 142.74 1.11 Allowed 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 122.55 2.166 . . . . 0.0 112.582 179.912 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.488 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 51.1 Cg_exo -53.8 -48.57 21.08 Favored 'Trans proline' 0 C--N 1.35 0.626 0 C-N-CA 122.53 2.154 . . . . 0.0 113.09 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -64.54 -25.14 67.85 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.926 -179.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.497 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.67 -47.83 24.63 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.501 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.488 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -75.12 -25.45 58.46 Favored 'General case' 0 C--N 1.331 -0.207 0 CA-C-O 120.807 0.337 . . . . 0.0 110.621 -179.61 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.2 -47.25 65.36 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.715 179.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.51 -18.03 64.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.769 179.751 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -80.3 -23.08 40.94 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.854 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.3 137.09 54.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.003 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 35.0 t . . . . . 0 C--O 1.25 1.096 0 CA-C-O 118.348 -0.834 . . . . 0.0 110.921 -179.847 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.483 0.901 0 N-CA-C 111.124 -0.375 . . . . 0.0 111.124 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 85.3 mt -70.9 -18.65 62.66 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.994 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.9 -33.61 59.77 Favored Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.884 -0.674 . . . . 0.0 112.973 179.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.506 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 45.7 t -55.97 -51.1 83.21 Favored Pre-proline 0 CA--C 1.536 0.439 0 N-CA-C 112.565 0.58 . . . . 0.0 112.565 -178.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.506 ' HD2' ' N ' ' A' ' 5' ' ' SER . 35.0 Cg_endo -65.0 -33.47 51.01 Favored 'Trans proline' 0 C--N 1.352 0.726 0 C-N-CA 121.971 1.781 . . . . 0.0 112.609 -179.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -66.42 -43.27 86.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 0.0 111.017 -179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 42.7 t80 -70.93 -40.31 72.14 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.109 -0.496 . . . . 0.0 110.992 -179.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.93 -38.8 92.42 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.368 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.78 -34.76 69.69 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.173 -179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.3 tpp -67.62 -41.24 84.28 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.858 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -64.42 -32.09 73.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.133 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 78.0 t80 -66.55 -48.1 70.75 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.358 -0.383 . . . . 0.0 110.909 -179.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -60.71 -44.13 96.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.797 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 25.1 t70 -66.06 -32.83 74.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.706 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . 0.444 ' HA ' ' NZ ' ' A' ' 19' ' ' LYS . 22.5 t70 -68.24 -37.64 81.0 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.459 179.665 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -75.86 -31.06 59.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.506 179.659 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -69.97 -43.85 70.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.24 -179.723 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.444 ' NZ ' ' HA ' ' A' ' 16' ' ' ASP . 9.2 ptpp? -65.55 -32.91 74.76 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.748 0.309 . . . . 0.0 111.021 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -67.38 -51.26 54.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.057 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.458 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -55.68 -47.1 77.32 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.014 -0.539 . . . . 0.0 111.902 -179.733 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.458 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.6 pt-20 -66.55 -37.16 84.39 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.749 0.309 . . . . 0.0 111.671 -178.896 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.452 ' O ' HD13 ' A' ' 27' ' ' LEU . 5.8 m-20 -65.22 -43.52 91.23 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.797 0.332 . . . . 0.0 111.237 -179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -60.56 -54.89 39.95 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 30.2 m -52.39 -45.41 45.2 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.354 0 N-CA-C 112.561 0.578 . . . . 0.0 112.561 -177.615 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.537 HG13 HD13 ' A' ' 27' ' ' LEU . 7.4 p -74.51 -38.18 45.59 Favored 'Isoleucine or valine' 0 C--O 1.233 0.211 0 CA-C-O 120.679 0.276 . . . . 0.0 110.806 179.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.537 HD13 HG13 ' A' ' 26' ' ' VAL . 1.0 OUTLIER -63.66 -24.54 67.83 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 179.085 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -67.35 -32.57 73.59 Favored 'General case' 0 CA--C 1.518 -0.262 0 N-CA-C 109.141 -0.689 . . . . 0.0 109.141 178.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.725 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.59 -32.12 67.7 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.354 178.529 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -45.12 69.88 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.46 0.648 . . . . 0.0 109.367 177.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.452 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 58.1 m -64.43 -39.44 93.84 Favored 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.998 -1.001 . . . . 0.0 110.31 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.725 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -63.89 -41.68 93.32 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.338 0 N-CA-C 109.219 -0.66 . . . . 0.0 109.219 179.052 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.59 -43.48 93.67 Favored 'General case' 0 N--CA 1.456 -0.135 0 CA-C-N 115.577 -0.738 . . . . 0.0 110.475 178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.437 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -61.49 -49.53 76.1 Favored Glycine 0 N--CA 1.449 -0.487 0 N-CA-C 111.0 -0.84 . . . . 0.0 111.0 178.929 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.572 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.94 -21.84 66.45 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 114.977 -0.611 . . . . 0.0 110.429 178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.488 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.4 m-70 -76.29 -31.97 58.52 Favored 'General case' 0 CA--C 1.505 -0.78 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.252 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.65 -32.58 59.23 Favored Glycine 0 N--CA 1.434 -1.461 0 CA-C-N 114.279 -1.328 . . . . 0.0 110.898 178.761 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.572 HG22 ' HA ' ' A' ' 35' ' ' ALA . 15.1 tt -78.44 -36.51 20.43 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.185 0 C-N-CA 120.885 -0.326 . . . . 0.0 110.363 179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.816 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.03 -35.73 59.39 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.816 ' N ' HD12 ' A' ' 39' ' ' LEU . 36.1 p -69.78 -40.49 76.01 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-O 120.963 0.411 . . . . 0.0 110.881 -179.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.635 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.5 m-85 -76.53 -33.45 58.58 Favored 'General case' 0 C--N 1.316 -0.848 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.803 -179.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.58 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.5 -46.89 83.23 Favored 'General case' 0 N--CA 1.443 -0.794 0 CA-C-O 121.943 0.878 . . . . 0.0 108.852 176.305 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.418 HG23 ' O ' ' A' ' 39' ' ' LEU . 97.9 t -70.27 -54.35 19.01 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.659 0 CA-C-N 114.927 -1.033 . . . . 0.0 112.112 -179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 24.1 m-85 -76.25 -54.45 6.78 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.859 1.799 . . . . 0.0 115.859 -177.438 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.98 -45.56 49.33 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.833 -1.53 . . . . 0.0 114.458 -175.361 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.468 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.63 -81.52 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.525 -0.47 . . . . 0.0 111.402 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 46.8 -147.33 0.17 Allowed 'General case' 0 C--N 1.331 -0.202 0 N-CA-C 109.796 -0.446 . . . . 0.0 109.796 -179.043 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -117.64 10.63 13.46 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.963 0.411 . . . . 0.0 110.263 178.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 26.1 m95 -91.05 -24.99 19.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.306 179.767 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -68.97 -32.96 72.91 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.384 -0.371 . . . . 0.0 111.291 -179.128 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 26.4 pt -63.29 -28.03 44.24 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-O 120.919 0.39 . . . . 0.0 110.618 179.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 65.1 tttm -53.84 -52.15 61.33 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.025 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.76 44.28 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.112 -1.042 . . . . 0.0 113.275 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.487 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 7.4 ptp180 -151.67 99.1 2.56 Favored 'General case' 0 CA--C 1.532 0.271 0 CA-C-O 121.719 0.771 . . . . 0.0 111.45 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.488 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -72.48 -18.01 61.71 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.221 -0.9 . . . . 0.0 111.212 179.37 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.562 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.37 -52.77 0.17 Allowed Pre-proline 0 N--CA 1.468 0.441 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -178.47 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.574 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 83.1 Cg_exo -48.76 -44.56 31.05 Favored 'Trans proline' 0 C--N 1.356 0.929 0 C-N-CA 121.372 1.381 . . . . 0.0 112.173 179.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.4 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -47.75 47.35 Favored Glycine 0 CA--C 1.504 -0.597 0 CA-C-N 115.994 -0.548 . . . . 0.0 113.274 179.176 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.11 -38.31 90.6 Favored 'General case' 0 C--N 1.311 -1.074 0 CA-C-N 114.846 -0.677 . . . . 0.0 111.308 -179.548 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.635 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.79 -34.16 76.69 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.051 0.453 . . . . 0.0 110.275 179.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.58 ' CE1' HD12 ' A' ' 42' ' ' LEU . 2.5 m-85 -75.31 -44.35 45.94 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.007 179.23 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.66 -39.19 88.1 Favored 'General case' 0 N--CA 1.448 -0.571 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.906 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.628 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.9 m-85 -71.3 -54.7 9.94 Favored 'General case' 0 C--N 1.329 -0.315 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -178.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.805 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.71 -23.94 49.34 Favored 'General case' 0 C--O 1.221 -0.421 0 N-CA-C 111.857 0.317 . . . . 0.0 111.857 -179.726 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.36 42.74 Favored Glycine 0 CA--C 1.518 0.236 0 C-N-CA 119.957 -1.116 . . . . 0.0 111.648 179.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.87 -26.11 5.24 Favored 'Isoleucine or valine' 0 C--N 1.334 -0.108 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 178.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.653 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.55 -51.32 70.64 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-N 114.943 -1.026 . . . . 0.0 110.663 178.625 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.805 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 37.9 Cg_endo -63.19 -41.31 28.23 Favored 'Trans proline' 0 N--CA 1.45 -1.052 0 C-N-CA 123.209 2.606 . . . . 0.0 112.256 -178.512 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.464 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.4 tm? -56.68 -56.8 16.79 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.943 -0.391 . . . . 0.0 109.943 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -57.32 -52.41 65.44 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.952 -0.567 . . . . 0.0 111.699 179.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 73.9 mt -49.65 -52.99 26.94 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 -178.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.548 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 31.4 tp -56.77 -45.34 82.16 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.854 0.316 . . . . 0.0 111.854 -179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.1 mp -71.01 -38.6 72.64 Favored 'General case' 0 N--CA 1.467 0.393 0 N-CA-C 113.163 0.801 . . . . 0.0 113.163 -178.543 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.46 -22.88 37.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.039 0.447 . . . . 0.0 110.436 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.499 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -92.18 -8.02 46.69 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.793 -0.639 . . . . 0.0 109.997 178.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.548 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.4 tp -78.95 146.2 67.57 Favored Pre-proline 0 C--O 1.231 0.11 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.47 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.536 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 54.5 Cg_exo -52.77 160.01 4.39 Favored 'Trans proline' 0 C--N 1.348 0.502 0 C-N-CA 122.051 1.834 . . . . 0.0 111.365 178.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.415 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 50.8 Cg_exo -54.19 -57.38 1.86 Allowed 'Trans proline' 0 C--N 1.344 0.31 0 C-N-CA 122.018 1.812 . . . . 0.0 113.199 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 76.5 ttt180 -62.83 -26.25 68.66 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.836 0.35 . . . . 0.0 111.213 -179.584 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.85 -45.87 33.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.14 -0.482 . . . . 0.0 111.794 -179.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.415 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.5 OUTLIER -78.18 -24.3 47.25 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 120.723 -0.391 . . . . 0.0 110.669 -179.029 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.25 -43.83 63.75 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.403 179.484 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.95 -15.6 63.07 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.943 -0.571 . . . . 0.0 110.92 179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.73 -11.84 54.99 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.928 179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -80.67 141.73 34.63 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.116 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.9 t . . . . . 0 C--O 1.249 1.073 0 CA-C-O 118.225 -0.893 . . . . 0.0 111.06 -179.902 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo . . . . . 0 N--CA 1.485 0.984 0 N-CA-C 111.188 -0.351 . . . . 0.0 111.188 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.447 ' C ' ' HD2' ' A' ' 6' ' ' PRO . 3.7 mm? -70.75 -17.58 62.79 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.852 179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.13 -33.42 65.08 Favored Glycine 0 CA--C 1.52 0.388 0 C-N-CA 121.118 -0.563 . . . . 0.0 113.353 -179.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.642 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 42.8 t -61.15 -51.38 79.01 Favored Pre-proline 0 CA--C 1.535 0.38 0 CA-C-N 117.067 0.433 . . . . 0.0 111.879 -179.301 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.642 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 31.9 Cg_exo -59.58 -30.16 91.67 Favored 'Trans proline' 0 C--N 1.354 0.863 0 C-N-CA 121.906 1.738 . . . . 0.0 111.56 178.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -65.52 -33.74 76.64 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 115.776 -0.647 . . . . 0.0 110.452 179.719 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -75.6 -35.98 60.41 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.602 179.744 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.96 -30.54 63.93 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.061 -0.518 . . . . 0.0 110.806 179.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.69 -46.22 47.64 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.025 -0.534 . . . . 0.0 111.165 -179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.8 ptm -63.84 -31.8 73.1 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.263 -0.426 . . . . 0.0 110.687 179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -63.82 -36.08 82.74 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 0.0 110.495 179.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -67.0 -34.31 77.48 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.576 179.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.9 mtpt -70.09 -46.54 64.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.93 -179.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -66.24 -33.96 76.93 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.947 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -68.49 -48.48 64.34 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.0 -179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.61 -35.2 80.13 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.11 -0.495 . . . . 0.0 110.962 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 17.7 t70 -69.72 -39.38 76.87 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.258 -179.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.9 tttp -68.37 -37.01 80.04 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.485 -0.325 . . . . 0.0 111.081 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.53 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.71 -53.14 45.0 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.354 -0.385 . . . . 0.0 111.078 -179.925 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.04 -48.57 70.39 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.068 -0.515 . . . . 0.0 111.692 -179.424 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.447 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.6 pt-20 -63.92 -31.26 72.38 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 120.944 0.402 . . . . 0.0 110.996 -179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.448 ' O ' HD13 ' A' ' 27' ' ' LEU . 89.2 m-20 -67.64 -42.6 82.0 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.14 179.76 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -61.63 -50.91 70.65 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 111.914 0.338 . . . . 0.0 111.914 -179.537 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.0 m -54.75 -41.74 58.14 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 CA-C-N 116.33 -0.395 . . . . 0.0 111.917 -178.105 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.5 t -74.79 -41.8 47.16 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-O 120.858 0.361 . . . . 0.0 110.746 179.575 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.511 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.6 OUTLIER -64.63 -20.6 66.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.372 179.54 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -70.89 -37.03 72.98 Favored 'General case' 0 C--N 1.33 -0.25 0 N-CA-C 109.074 -0.713 . . . . 0.0 109.074 178.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.728 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.16 -32.4 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.603 -0.726 . . . . 0.0 109.801 178.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.49 -45.6 68.57 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.232 0.539 . . . . 0.0 109.581 177.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.445 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 96.1 p -64.14 -38.2 90.19 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.2 179.665 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.728 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -65.61 -41.36 90.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.399 0 N-CA-C 109.4 -0.592 . . . . 0.0 109.4 179.099 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -59.7 -42.81 93.84 Favored 'General case' 0 C--O 1.232 0.17 0 CA-C-N 115.763 -0.653 . . . . 0.0 110.425 179.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 64' ' ' TYR . . . -61.94 -49.38 76.13 Favored Glycine 0 N--CA 1.451 -0.356 0 N-CA-C 110.949 -0.86 . . . . 0.0 110.949 178.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.605 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.03 -20.7 66.26 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.063 -0.569 . . . . 0.0 110.281 178.256 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.484 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.6 m-70 -75.76 -31.75 59.67 Favored 'General case' 0 CA--C 1.505 -0.786 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.581 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -74.12 -32.61 58.24 Favored Glycine 0 N--CA 1.434 -1.494 0 CA-C-N 114.289 -1.323 . . . . 0.0 110.62 178.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.605 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.7 tt -77.86 -36.72 22.61 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.227 0 C-N-CA 121.051 -0.26 . . . . 0.0 110.318 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.83 -37.78 58.73 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.187 0.44 . . . . 0.0 112.187 -179.253 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.15 -38.28 78.7 Favored 'General case' 0 CA--C 1.511 -0.542 0 CA-C-O 120.922 0.391 . . . . 0.0 111.187 -178.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.681 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.4 m-85 -77.9 -33.61 51.84 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.418 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.578 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.1 mp -57.27 -47.37 81.62 Favored 'General case' 0 N--CA 1.443 -0.804 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 176.477 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.449 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.8 t -70.16 -54.06 20.51 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.695 0 CA-C-N 115.046 -0.979 . . . . 0.0 112.234 -179.096 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 30.5 t80 -76.23 -54.12 7.25 Favored 'General case' 0 CA--C 1.549 0.939 0 N-CA-C 115.77 1.767 . . . . 0.0 115.77 -177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.496 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.84 -40.22 61.16 Favored 'General case' 0 CA--C 1.534 0.35 0 CA-C-N 113.98 -1.464 . . . . 0.0 114.817 -175.197 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.429 ' SG ' ' O ' ' A' ' 42' ' ' LEU . 0.2 OUTLIER -67.95 9.28 0.31 Allowed 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 118.282 0.492 . . . . 0.0 112.192 -178.549 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.504 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -43.92 153.52 0.13 Allowed 'General case' 0 C--N 1.333 -0.121 0 N-CA-C 109.724 -0.472 . . . . 0.0 109.724 178.851 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.501 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -59.34 6.42 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 -178.607 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.504 ' H ' ' C ' ' A' ' 47' ' ' ALA . 26.4 m95 -90.78 -23.11 20.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.723 0.297 . . . . 0.0 110.899 179.042 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.416 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.8 OUTLIER -69.04 -22.41 64.04 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.176 -179.502 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.501 HG12 ' O ' ' A' ' 48' ' ' ALA . 23.5 pt -70.1 -29.41 39.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 0.0 110.99 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.3 tptt -54.74 -33.68 61.5 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.024 -0.534 . . . . 0.0 110.874 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.58 29.39 0.03 OUTLIER Glycine 0 CA--C 1.52 0.35 0 C-N-CA 120.519 -0.848 . . . . 0.0 113.307 179.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.418 ' O ' ' CG ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -124.28 97.65 5.42 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.711 0.767 . . . . 0.0 110.583 179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.464 ' O ' ' N ' ' A' ' 58' ' ' GLY . 36.1 mt -74.56 -19.23 60.41 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.135 179.267 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.597 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.57 -53.63 0.18 Allowed Pre-proline 0 CA--C 1.535 0.374 0 N-CA-C 112.832 0.678 . . . . 0.0 112.832 -178.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.597 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.8 Cg_exo -48.77 -46.43 24.53 Favored 'Trans proline' 0 C--N 1.355 0.895 0 C-N-CA 121.417 1.411 . . . . 0.0 111.987 178.706 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.464 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.35 -48.0 42.03 Favored Glycine 0 CA--C 1.506 -0.508 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.528 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.86 -39.22 93.69 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 114.923 -0.638 . . . . 0.0 111.31 -179.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.681 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -62.49 -34.91 77.8 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.131 0.491 . . . . 0.0 109.976 179.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.583 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.0 m-85 -73.89 -42.84 60.11 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 115.578 -0.737 . . . . 0.0 109.767 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -67.38 -38.95 85.52 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-N 115.278 -0.873 . . . . 0.0 110.796 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.553 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.3 m-85 -71.49 -55.1 8.54 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 112.659 0.614 . . . . 0.0 112.659 -178.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.817 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.6 m-85 -77.86 -24.22 48.63 Favored 'General case' 0 C--O 1.222 -0.354 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 -179.603 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.98 -31.01 44.78 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 119.948 -1.12 . . . . 0.0 111.609 179.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.02 -27.88 4.9 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.115 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 178.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.652 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -49.39 -51.16 60.38 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 114.955 -1.021 . . . . 0.0 110.974 178.477 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.817 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 43.9 Cg_endo -64.4 -40.43 24.66 Favored 'Trans proline' 0 N--CA 1.448 -1.202 0 C-N-CA 123.053 2.502 . . . . 0.0 112.232 -178.353 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.448 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.8 tm? -57.6 -55.52 33.77 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 49.4 mt -55.58 -53.6 54.39 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.876 -0.602 . . . . 0.0 111.161 179.615 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 88.8 mt -49.68 -52.53 30.35 Favored 'General case' 0 C--O 1.223 -0.31 0 O-C-N 123.403 0.439 . . . . 0.0 112.091 -179.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.557 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 62.6 tp -57.39 -44.53 84.57 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 111.895 0.332 . . . . 0.0 111.895 -179.361 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.448 HD13 ' O ' ' A' ' 69' ' ' LEU . 11.0 mp -71.42 -39.74 70.89 Favored 'General case' 0 N--CA 1.468 0.47 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -178.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -81.33 -23.97 37.44 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 121.033 0.444 . . . . 0.0 110.379 -179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.511 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -90.48 -7.36 53.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.894 -0.594 . . . . 0.0 109.722 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.557 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 3.8 tp -77.98 144.8 68.55 Favored Pre-proline 0 C--O 1.231 0.117 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.355 179.521 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.51 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 57.7 Cg_exo -52.52 156.14 8.99 Favored 'Trans proline' 0 C--N 1.347 0.477 0 C-N-CA 122.117 1.878 . . . . 0.0 111.091 178.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.416 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 50.8 Cg_exo -51.7 -58.25 1.71 Allowed 'Trans proline' 0 C--N 1.344 0.339 0 C-N-CA 122.081 1.854 . . . . 0.0 113.276 -179.016 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -63.58 -24.97 68.03 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.793 0.33 . . . . 0.0 111.187 -179.65 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.53 -45.2 31.71 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.765 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.416 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.6 OUTLIER -78.43 -25.26 45.96 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.666 -0.413 . . . . 0.0 110.521 -179.071 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.98 -43.19 65.53 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.089 -0.505 . . . . 0.0 110.543 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.93 -16.59 63.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.988 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -88.4 -10.74 48.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.956 179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.2 154.26 22.1 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.119 -0.492 . . . . 0.0 111.093 179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 69.8 p . . . . . 0 C--O 1.249 1.035 0 CA-C-O 118.198 -0.906 . . . . 0.0 110.92 -179.916 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.879 0 N-CA-C 111.19 -0.35 . . . . 0.0 111.19 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.486 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 76.9 mt -71.42 -22.21 61.88 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.184 -0.462 . . . . 0.0 111.099 179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.84 -33.79 57.15 Favored Glycine 0 CA--C 1.519 0.319 0 C-N-CA 121.038 -0.601 . . . . 0.0 113.25 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.606 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 68.6 m -53.23 -51.26 76.99 Favored Pre-proline 0 CA--C 1.535 0.378 0 N-CA-C 112.289 0.477 . . . . 0.0 112.289 -178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.606 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 39.9 Cg_exo -57.3 -34.52 98.0 Favored 'Trans proline' 0 C--N 1.353 0.802 0 C-N-CA 121.952 1.768 . . . . 0.0 112.274 179.673 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -66.56 -34.61 78.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.113 -0.494 . . . . 0.0 110.765 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -75.94 -40.44 54.07 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.584 179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.12 83.09 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.918 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -73.1 -31.13 64.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.86 179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 47.3 ttm -72.13 -43.48 64.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.981 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -63.87 -37.87 88.98 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.888 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.8 t80 -59.94 -50.86 72.12 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.424 -0.353 . . . . 0.0 110.746 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 60.6 tttm -59.46 -38.18 80.11 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.699 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -66.32 -39.79 89.51 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 116.05 -0.523 . . . . 0.0 111.058 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -66.06 -41.96 90.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.985 -179.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 -70.67 -32.78 70.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.264 -0.425 . . . . 0.0 110.73 179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.526 ' HA ' HD23 ' A' ' 21' ' ' LEU . 24.1 t70 -68.5 -40.29 80.93 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.431 179.594 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -68.48 -28.86 67.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.062 -0.517 . . . . 0.0 110.443 179.562 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.68 -53.18 36.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.328 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.657 ' O ' HG23 ' A' ' 25' ' ' VAL . 1.5 pp -59.31 -42.56 91.65 Favored 'General case' 0 CA--C 1.512 -0.491 0 CA-C-N 116.502 -0.317 . . . . 0.0 111.198 -179.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.638 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -67.36 -42.98 82.58 Favored 'General case' 0 N--CA 1.438 -1.066 0 CA-C-N 115.957 -0.565 . . . . 0.0 112.357 -176.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.572 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.4 m-20 -63.14 -54.9 30.56 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 121.027 -0.269 . . . . 0.0 111.383 -179.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 6.8 tp -51.95 -52.18 52.0 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 112.36 0.504 . . . . 0.0 112.36 -179.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.657 HG23 ' O ' ' A' ' 21' ' ' LEU . 74.8 t -50.12 -49.85 21.34 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.602 0 N-CA-C 112.303 0.483 . . . . 0.0 112.303 -178.299 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 39.1 t -72.57 -40.36 62.66 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 CA-C-N 116.507 -0.315 . . . . 0.0 111.14 -179.908 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.572 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 92.6 mt -63.68 -21.82 66.58 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.364 -0.38 . . . . 0.0 110.396 179.851 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 6.1 m-20 -70.68 -31.08 67.85 Favored 'General case' 0 N--CA 1.455 -0.208 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.719 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.89 -34.44 69.17 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 115.543 -0.753 . . . . 0.0 109.267 178.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.96 -39.68 79.35 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 177.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.438 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.6 t -66.54 -39.89 88.81 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 114.899 -1.046 . . . . 0.0 110.157 179.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.719 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -65.57 -39.77 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.35 0 N-CA-C 108.937 -0.764 . . . . 0.0 108.937 179.038 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.38 -43.06 96.95 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.525 -0.762 . . . . 0.0 110.166 178.768 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.461 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.78 -49.24 78.09 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.833 -0.907 . . . . 0.0 110.833 178.715 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.64 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.3 -23.07 66.93 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 114.849 -0.675 . . . . 0.0 110.255 178.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.492 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 12.8 m-70 -75.27 -31.97 60.91 Favored 'General case' 0 CA--C 1.505 -0.773 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 179.482 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.584 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.83 -33.57 60.02 Favored Glycine 0 N--CA 1.435 -1.396 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.999 178.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.64 HG22 ' HA ' ' A' ' 35' ' ' ALA . 16.8 tt -78.52 -36.55 20.23 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.196 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.452 -179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.83 HD12 ' N ' ' A' ' 40' ' ' SER . 4.2 pp -76.09 -35.85 59.18 Favored 'General case' 0 C--N 1.329 -0.314 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -179.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.83 ' N ' HD12 ' A' ' 39' ' ' LEU . 35.5 p -69.54 -39.69 77.33 Favored 'General case' 0 CA--C 1.508 -0.636 0 CA-C-O 121.014 0.435 . . . . 0.0 110.957 -179.092 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.626 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 12.8 m-85 -77.93 -32.33 51.53 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.727 -0.67 . . . . 0.0 110.565 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.567 HD12 ' CE1' ' A' ' 61' ' ' TYR . 1.0 OUTLIER -57.3 -47.11 82.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-O 122.063 0.935 . . . . 0.0 108.565 176.22 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.406 HG23 ' O ' ' A' ' 39' ' ' LEU . 99.4 t -70.05 -54.35 19.29 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.727 0 CA-C-N 114.691 -1.14 . . . . 0.0 112.074 -179.228 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -77.2 -54.76 6.1 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 116.045 1.869 . . . . 0.0 116.045 -177.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.499 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -72.1 -38.29 69.36 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 113.839 -1.528 . . . . 0.0 114.374 -175.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.481 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.9 t -69.54 15.93 0.07 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 118.025 0.375 . . . . 0.0 111.886 -178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.508 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.85 156.13 0.77 Allowed 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 178.557 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.491 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.62 7.43 0.05 OUTLIER 'General case' 0 C--N 1.325 -0.457 0 N-CA-C 112.31 0.485 . . . . 0.0 112.31 -178.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.508 ' H ' ' C ' ' A' ' 47' ' ' ALA . 29.4 m95 -90.55 -23.99 20.73 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-O 120.899 0.381 . . . . 0.0 110.742 178.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.428 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 0.7 OUTLIER -68.11 -25.14 65.16 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.093 -0.503 . . . . 0.0 111.392 -179.313 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.491 HG12 ' O ' ' A' ' 48' ' ' ALA . 39.7 pt -71.33 -29.43 35.71 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-O 120.662 0.267 . . . . 0.0 111.246 -179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 18.0 tppt? -55.86 -35.75 66.81 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.287 -0.415 . . . . 0.0 110.818 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 158.58 32.28 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.621 -0.8 . . . . 0.0 113.101 179.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.479 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 1.9 ttm180 -128.43 98.08 4.93 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.724 0.773 . . . . 0.0 110.653 179.777 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.465 ' O ' ' N ' ' A' ' 58' ' ' GLY . 3.8 pp -75.28 -19.14 59.86 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.453 -0.794 . . . . 0.0 110.937 179.034 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.594 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.35 -54.29 0.17 Allowed Pre-proline 0 N--CA 1.467 0.381 0 N-CA-C 113.185 0.809 . . . . 0.0 113.185 -178.195 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 88.6 Cg_exo -48.43 -45.23 27.5 Favored 'Trans proline' 0 C--N 1.355 0.872 0 C-N-CA 121.321 1.347 . . . . 0.0 111.749 178.962 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.465 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.93 -48.49 45.21 Favored Glycine 0 CA--C 1.503 -0.697 0 CA-C-N 115.752 -0.658 . . . . 0.0 113.276 179.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.13 -36.14 83.06 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 115.041 -0.579 . . . . 0.0 111.587 -179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.626 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.11 -35.57 81.54 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.189 0.519 . . . . 0.0 110.071 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.59 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 2.9 m-85 -72.82 -49.0 33.05 Favored 'General case' 0 CA--C 1.51 -0.586 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.997 179.201 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -64.37 -38.22 90.26 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.219 -0.9 . . . . 0.0 110.933 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.692 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 20.1 t80 -70.97 -55.26 8.72 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 112.797 0.665 . . . . 0.0 112.797 -178.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.788 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.6 OUTLIER -77.7 -24.19 49.28 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.696 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.11 -30.49 46.4 Favored Glycine 0 N--CA 1.453 -0.225 0 C-N-CA 120.105 -1.045 . . . . 0.0 111.639 179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.432 HG22 HD13 ' A' ' 70' ' ' LEU . 1.8 p -90.16 -29.65 4.99 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.137 0 N-CA-C 109.195 -0.668 . . . . 0.0 109.195 178.222 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.692 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.28 -51.87 53.61 Favored Pre-proline 0 C--N 1.328 -0.352 0 CA-C-N 114.695 -1.139 . . . . 0.0 111.247 179.201 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.788 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.5 Cg_endo -64.89 -40.2 22.19 Favored 'Trans proline' 0 N--CA 1.448 -1.166 0 C-N-CA 123.015 2.476 . . . . 0.0 112.323 -178.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.08 -54.63 44.79 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.872 0.368 . . . . 0.0 110.545 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.432 HD13 HG22 ' A' ' 66' ' ' VAL . 11.1 mp -57.37 -53.66 55.59 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.368 179.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 87.1 mt -50.64 -49.33 57.2 Favored 'General case' 0 C--N 1.33 -0.257 0 O-C-N 123.251 0.344 . . . . 0.0 111.8 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.524 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 45.9 tp -60.05 -43.21 95.54 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 111.805 0.298 . . . . 0.0 111.805 -179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 60.7 mt -71.91 -38.55 69.89 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 112.539 0.57 . . . . 0.0 112.539 -178.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.8 pp -82.16 -21.41 36.58 Favored 'General case' 0 C--O 1.235 0.292 0 CA-C-O 120.985 0.421 . . . . 0.0 110.311 179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.13 -3.88 55.06 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.373 0.606 . . . . 0.0 109.779 178.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.535 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 1.5 tp -85.97 148.14 47.33 Favored Pre-proline 0 CA--C 1.528 0.099 0 CA-C-N 114.977 -1.01 . . . . 0.0 109.964 179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.535 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.3 Cg_exo -54.19 159.14 8.24 Favored 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 121.937 1.758 . . . . 0.0 111.273 179.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.468 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 17.4 Cg_endo -57.38 -57.17 1.36 Allowed 'Trans proline' 0 C--N 1.345 0.35 0 C-N-CA 122.004 1.803 . . . . 0.0 112.97 -179.318 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -62.48 -26.7 68.67 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.308 -0.405 . . . . 0.0 111.108 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.92 -45.98 32.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.925 -179.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.468 ' CD2' ' HA ' ' A' ' 78' ' ' PRO . 0.6 OUTLIER -76.98 -25.41 52.73 Favored 'General case' 0 C--N 1.333 -0.115 0 C-N-CA 120.729 -0.388 . . . . 0.0 110.905 -178.868 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.89 -47.8 57.22 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.365 -0.379 . . . . 0.0 110.694 179.674 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.91 -13.73 62.61 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.991 -0.55 . . . . 0.0 111.148 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.47 -16.76 41.36 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.083 179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -92.15 143.55 26.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.216 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 65.7 p . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.333 -0.841 . . . . 0.0 110.773 179.858 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo . . . . . 0 N--CA 1.483 0.887 0 N-CA-C 111.091 -0.388 . . . . 0.0 111.091 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.476 ' N ' HD22 ' A' ' 3' ' ' LEU . 3.3 mm? -71.35 -18.71 62.36 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.118 -179.818 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.85 -33.69 59.85 Favored Glycine 0 CA--C 1.519 0.293 0 C-N-CA 120.819 -0.705 . . . . 0.0 113.206 -179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.505 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 53.1 m -56.79 -50.85 85.63 Favored Pre-proline 0 CA--C 1.537 0.453 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -179.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.505 ' HD2' ' N ' ' A' ' 5' ' ' SER . 31.5 Cg_endo -65.1 -28.22 56.93 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 122.034 1.823 . . . . 0.0 112.686 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -64.03 -57.61 9.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.517 -0.311 . . . . 0.0 111.363 -179.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -65.88 -31.41 72.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.276 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -68.94 -46.14 68.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.386 -0.37 . . . . 0.0 111.203 -179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.87 -37.15 86.31 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.918 179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.9 ttt -67.16 -28.59 68.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.129 -0.487 . . . . 0.0 110.6 179.777 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -67.42 -40.2 85.5 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.842 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -65.04 -31.75 73.13 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.596 179.611 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 94.3 mttt -69.94 -50.68 39.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.047 -0.524 . . . . 0.0 110.835 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.15 -28.94 69.17 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.082 -0.508 . . . . 0.0 111.02 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -70.56 -48.65 54.3 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.214 -0.448 . . . . 0.0 110.931 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.8 t70 -68.03 -34.51 76.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.127 -0.488 . . . . 0.0 111.097 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.9 t70 -67.79 -46.56 71.63 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.168 -179.74 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 60.5 tttm -62.38 -38.25 88.86 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.144 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.563 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -64.81 -50.67 65.8 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.399 -0.364 . . . . 0.0 111.154 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.438 HD23 ' N ' ' A' ' 22' ' ' GLU . 0.0 OUTLIER -54.0 -48.78 70.08 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 116.139 -0.482 . . . . 0.0 111.635 -179.305 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.438 ' N ' HD23 ' A' ' 21' ' ' LEU . 12.5 pt-20 -65.04 -31.23 72.36 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.877 0.37 . . . . 0.0 110.802 -179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.49 ' O ' HD13 ' A' ' 27' ' ' LEU . 93.3 m-20 -65.78 -46.38 78.96 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.339 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.563 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 3.0 mt -60.94 -52.44 65.01 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 111.845 0.313 . . . . 0.0 111.845 -179.366 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 22' ' ' GLU . 33.7 m -53.57 -42.6 50.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.309 0 CA-C-N 116.158 -0.474 . . . . 0.0 112.254 -177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 59.5 t -75.28 -41.76 43.73 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-O 120.901 0.382 . . . . 0.0 110.915 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.572 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.7 OUTLIER -64.25 -21.93 66.76 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.4 179.833 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -70.07 -30.66 67.96 Favored 'General case' 0 N--CA 1.454 -0.271 0 N-CA-C 109.256 -0.646 . . . . 0.0 109.256 178.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.718 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -74.59 -34.4 62.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.597 -0.729 . . . . 0.0 109.66 178.738 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.19 -42.73 75.43 Favored 'General case' 0 C--N 1.325 -0.469 0 CA-C-O 121.281 0.562 . . . . 0.0 109.525 177.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.0 t -65.39 -41.43 93.69 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.019 179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.718 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.8 OUTLIER -62.54 -41.09 90.68 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.295 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 179.086 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.97 -42.06 97.59 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.631 179.136 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.45 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.27 -50.17 67.53 Favored Glycine 0 C--N 1.333 0.37 0 N-CA-C 111.057 -0.817 . . . . 0.0 111.057 179.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.606 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -67.23 -20.1 65.63 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.113 -0.543 . . . . 0.0 110.184 178.452 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.476 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 6.3 m-70 -76.48 -32.27 58.25 Favored 'General case' 0 CA--C 1.5 -0.96 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 179.171 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.61 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.32 -33.09 59.3 Favored Glycine 0 N--CA 1.43 -1.7 0 CA-C-N 114.186 -1.37 . . . . 0.0 110.429 178.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.606 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.2 tt -77.08 -37.2 25.93 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.184 0 C-N-CA 120.942 -0.303 . . . . 0.0 110.468 179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.845 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.82 -37.24 59.27 Favored 'General case' 0 C--N 1.331 -0.22 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -179.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.845 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -72.71 -33.43 66.44 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.919 0.39 . . . . 0.0 110.853 -179.104 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.65 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 14.7 m-85 -79.7 -35.06 39.61 Favored 'General case' 0 C--N 1.316 -0.871 0 C-N-CA 120.307 -0.557 . . . . 0.0 109.822 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.501 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.2 mp -56.26 -45.83 79.89 Favored 'General case' 0 N--CA 1.445 -0.693 0 CA-C-O 121.747 0.784 . . . . 0.0 108.923 176.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 35.8 m -72.59 -45.47 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.705 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.168 -179.288 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.474 ' HB2' ' O ' ' A' ' 40' ' ' SER . 0.6 OUTLIER -76.15 -54.0 7.46 Favored 'General case' 0 CA--C 1.551 1.004 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -178.208 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.709 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 8.7 m-85 -78.68 -49.08 13.77 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 115.05 1.5 . . . . 0.0 115.05 -176.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.507 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 36.2 t -57.07 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.861 0 C-N-CA 119.516 -0.874 . . . . 0.0 111.562 -175.41 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.405 ' C ' ' O ' ' A' ' 46' ' ' CYS . . . 38.27 -139.51 0.04 OUTLIER 'General case' 0 N--CA 1.456 -0.154 0 N-CA-C 110.053 -0.351 . . . . 0.0 110.053 -179.278 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.431 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.88 18.75 10.17 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.956 0.408 . . . . 0.0 110.561 178.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.5 t-105 -90.37 -37.15 14.19 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.824 179.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.442 ' CB ' ' HG2' ' A' ' 57' ' ' PRO . 1.0 OUTLIER -69.17 -15.24 63.36 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.86 -0.609 . . . . 0.0 111.069 -179.484 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.431 HG12 ' O ' ' A' ' 48' ' ' ALA . 16.1 pt -58.62 -28.87 37.95 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.21 0 CA-C-N 116.267 -0.424 . . . . 0.0 110.865 179.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 32.1 mmmt -54.45 -29.96 51.29 Favored 'General case' 0 C--N 1.331 -0.223 0 CA-C-N 115.875 -0.602 . . . . 0.0 110.821 -179.865 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 138.73 26.08 0.3 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.479 -0.867 . . . . 0.0 113.357 179.607 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.417 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.5 OUTLIER -110.97 105.74 14.62 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 121.263 0.554 . . . . 0.0 110.244 179.472 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.446 ' O ' ' C ' ' A' ' 56' ' ' ALA . 50.8 mt -74.31 -18.87 60.64 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.16 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.619 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.47 -52.17 0.17 Allowed Pre-proline 0 N--CA 1.468 0.428 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -178.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.709 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 88.1 Cg_exo -49.88 -49.67 15.39 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 121.728 1.618 . . . . 0.0 112.055 178.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.442 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.41 -49.36 26.25 Favored Glycine 0 CA--C 1.506 -0.503 0 CA-C-N 115.943 -0.572 . . . . 0.0 114.014 179.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.96 -43.32 99.1 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-N 115.171 -0.515 . . . . 0.0 111.734 -179.02 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.65 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.5 -34.84 73.11 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.24 0.543 . . . . 0.0 110.164 179.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.652 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.6 m-30 -74.39 -44.36 52.41 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.169 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.17 86.82 Favored 'General case' 0 N--CA 1.448 -0.53 0 CA-C-N 115.57 -0.741 . . . . 0.0 110.673 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.605 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 9.1 m-85 -71.4 -54.77 9.61 Favored 'General case' 0 C--N 1.328 -0.358 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -179.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.827 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.5 OUTLIER -77.73 -24.19 49.16 Favored 'General case' 0 C--O 1.221 -0.446 0 N-CA-C 111.851 0.315 . . . . 0.0 111.851 -179.824 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.438 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.62 -31.42 45.21 Favored Glycine 0 N--CA 1.453 -0.214 0 C-N-CA 120.061 -1.066 . . . . 0.0 111.605 179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.3 p -91.8 -24.69 5.4 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 178.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.656 ' N ' ' HD2' ' A' ' 68' ' ' PRO . 0.0 OUTLIER -51.82 -50.53 77.28 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.714 178.297 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.827 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 38.0 Cg_endo -63.62 -39.75 33.62 Favored 'Trans proline' 0 N--CA 1.444 -1.4 0 C-N-CA 122.923 2.415 . . . . 0.0 111.882 -178.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.442 ' O ' HD23 ' A' ' 73' ' ' LEU . 10.0 tt -57.41 -58.15 9.53 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.185 179.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.41 ' O ' ' HG ' ' A' ' 74' ' ' LEU . 10.8 mp -55.29 -52.84 62.12 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.846 -0.615 . . . . 0.0 111.451 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.7 mt -49.78 -52.54 31.18 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.327 0.392 . . . . 0.0 112.041 -179.298 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.551 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 46.9 tp -56.83 -45.41 82.36 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.581 -0.281 . . . . 0.0 111.717 -179.548 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.442 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.5 mm? -70.47 -38.98 74.51 Favored 'General case' 0 N--CA 1.467 0.394 0 N-CA-C 113.032 0.753 . . . . 0.0 113.032 -178.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 70' ' ' LEU . 1.6 pp -82.02 -20.9 37.44 Favored 'General case' 0 C--O 1.233 0.228 0 CA-C-O 121.049 0.452 . . . . 0.0 110.452 179.924 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.572 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -93.55 -12.07 30.41 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.921 -0.581 . . . . 0.0 109.978 178.684 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.588 ' HG ' ' HD2' ' A' ' 77' ' ' PRO . 2.4 tp -73.42 150.6 89.4 Favored Pre-proline 0 N--CA 1.456 -0.164 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.322 179.65 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.588 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.9 Cg_exo -52.91 160.71 3.84 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.009 1.806 . . . . 0.0 111.206 178.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.42 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 25.5 Cg_endo -61.74 -56.24 0.86 Allowed 'Trans proline' 0 C--N 1.342 0.232 0 C-N-CA 121.884 1.723 . . . . 0.0 112.793 -179.585 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -63.95 -26.05 68.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.875 0.369 . . . . 0.0 111.109 -179.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.78 -47.19 26.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.077 -0.51 . . . . 0.0 111.691 -179.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.42 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.3 OUTLIER -76.7 -24.93 53.14 Favored 'General case' 0 N--CA 1.456 -0.171 0 C-N-CA 120.891 -0.324 . . . . 0.0 110.691 -179.035 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -72.2 -42.95 65.2 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.572 179.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.29 -18.24 64.48 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.922 -0.581 . . . . 0.0 110.765 179.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.53 -22.2 44.23 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.884 179.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -74.36 131.54 41.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.189 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.2 p . . . . . 0 C--O 1.249 1.054 0 CA-C-O 118.183 -0.913 . . . . 0.0 110.934 179.979 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.2 Cg_endo . . . . . 0 N--CA 1.483 0.906 0 N-CA-C 111.15 -0.365 . . . . 0.0 111.15 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 6.7 mp -71.15 -17.95 62.52 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.812 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.93 -33.96 59.37 Favored Glycine 0 CA--C 1.519 0.306 0 C-N-CA 120.973 -0.632 . . . . 0.0 113.491 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.605 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 69.3 m -55.87 -51.14 82.81 Favored Pre-proline 0 CA--C 1.536 0.416 0 N-CA-C 112.095 0.406 . . . . 0.0 112.095 -179.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.605 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 51.9 Cg_exo -56.15 -34.93 94.41 Favored 'Trans proline' 0 C--N 1.351 0.698 0 C-N-CA 122.053 1.836 . . . . 0.0 112.374 179.569 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -63.22 -44.4 95.36 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.82 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 82.5 t80 -67.6 -31.37 71.37 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.112 -0.495 . . . . 0.0 110.848 179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -72.91 -38.41 66.88 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.156 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.41 -41.75 84.39 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.028 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 95.6 mmm -66.05 -34.28 77.71 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.161 -0.472 . . . . 0.0 110.942 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -62.67 -37.84 88.0 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.919 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 76.1 t80 -65.6 -36.04 82.56 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.073 -0.512 . . . . 0.0 110.883 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 41.5 ttmt -69.71 -48.02 61.05 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.999 -179.751 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 48.9 m-20 -66.13 -32.22 73.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.264 -0.426 . . . . 0.0 110.968 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -69.71 -49.49 52.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.991 -179.822 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -66.57 -34.11 77.16 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.288 -0.415 . . . . 0.0 110.69 179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.554 ' HA ' HD23 ' A' ' 21' ' ' LEU . 21.9 t70 -64.45 -49.86 69.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.086 -0.506 . . . . 0.0 110.791 179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -61.56 -28.61 69.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.783 179.82 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.555 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.11 -56.68 8.96 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.197 -0.456 . . . . 0.0 111.555 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.681 ' HG ' ' N ' ' A' ' 22' ' ' GLU . 1.2 pp -54.93 -43.97 73.81 Favored 'General case' 0 CA--C 1.512 -0.498 0 CA-C-N 116.694 -0.23 . . . . 0.0 111.508 -179.176 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.681 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 12.8 pt-20 -67.35 -34.01 76.44 Favored 'General case' 0 N--CA 1.446 -0.643 0 N-CA-C 111.914 0.339 . . . . 0.0 111.914 -177.188 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.622 ' O ' HD13 ' A' ' 27' ' ' LEU . 10.5 m120 -67.71 -54.79 16.56 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.697 -0.401 . . . . 0.0 110.96 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 9.8 mt -53.52 -49.95 66.49 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.155 0.428 . . . . 0.0 112.155 -179.439 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.675 HG13 ' O ' ' A' ' 21' ' ' LEU . 19.6 m -53.68 -42.04 49.53 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -177.426 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.577 HG13 HD12 ' A' ' 27' ' ' LEU . 7.2 p -82.02 -39.13 16.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 CA-C-O 120.425 0.155 . . . . 0.0 111.369 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.622 HD13 ' O ' ' A' ' 23' ' ' ASN . 10.4 mp -61.69 -27.86 69.0 Favored 'General case' 0 C--O 1.231 0.125 0 N-CA-C 109.727 -0.471 . . . . 0.0 109.727 179.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -67.77 -38.11 82.97 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.925 179.173 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.684 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -68.5 -31.91 71.52 Favored 'General case' 0 CA--C 1.52 -0.192 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.739 178.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.449 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.69 -42.38 74.17 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.342 0.592 . . . . 0.0 109.7 177.791 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.432 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 34.0 t -67.42 -36.64 81.65 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-N 115.252 -0.886 . . . . 0.0 110.315 179.829 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.684 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -67.82 -44.1 85.73 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.266 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.075 179.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.434 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.86 -44.1 97.47 Favored 'General case' 0 CA--C 1.522 -0.132 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.838 179.797 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.416 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -61.92 -49.62 73.79 Favored Glycine 0 N--CA 1.449 -0.447 0 C-N-CA 120.564 -0.827 . . . . 0.0 111.314 179.049 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.589 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.72 -20.29 65.94 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.276 -0.462 . . . . 0.0 110.208 178.425 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.462 ' O ' ' HB2' ' A' ' 40' ' ' SER . 6.6 m-70 -76.12 -32.24 59.06 Favored 'General case' 0 CA--C 1.503 -0.832 0 N-CA-C 107.76 -1.2 . . . . 0.0 107.76 179.086 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.579 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -33.05 58.71 Favored Glycine 0 N--CA 1.435 -1.425 0 CA-C-N 114.265 -1.334 . . . . 0.0 110.854 178.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 35' ' ' ALA . 14.5 tt -77.4 -37.44 25.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 C-N-CA 121.03 -0.268 . . . . 0.0 110.383 179.98 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.89 HD12 ' N ' ' A' ' 40' ' ' SER . 4.1 pp -75.58 -38.1 59.4 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 112.307 0.484 . . . . 0.0 112.307 -179.268 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.89 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -69.2 -37.78 78.29 Favored 'General case' 0 CA--C 1.511 -0.54 0 CA-C-O 120.804 0.335 . . . . 0.0 110.982 -178.812 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.639 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -78.21 -32.69 50.02 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.515 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.555 HD23 ' O ' ' A' ' 38' ' ' ILE . 0.4 OUTLIER -58.1 -46.79 84.93 Favored 'General case' 0 N--CA 1.446 -0.671 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 176.262 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.445 HG23 ' O ' ' A' ' 39' ' ' LEU . 98.4 t -69.93 -53.85 21.88 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 CA-C-N 115.084 -0.962 . . . . 0.0 112.047 -179.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -76.11 -54.91 6.13 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 115.963 1.838 . . . . 0.0 115.963 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.521 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.78 -45.42 43.79 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 113.828 -1.533 . . . . 0.0 114.48 -175.236 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.511 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 18.1 t -58.46 -81.24 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 118.122 0.419 . . . . 0.0 111.615 -178.638 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 50.35 -146.39 0.42 Allowed 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 -178.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.497 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.03 9.08 9.89 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-O 121.092 0.472 . . . . 0.0 110.616 179.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -91.13 -26.53 19.06 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.868 -0.605 . . . . 0.0 111.208 179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.453 ' HB2' ' HG2' ' A' ' 57' ' ' PRO . 1.1 p90 -67.74 -23.39 65.25 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.242 -0.436 . . . . 0.0 111.455 -179.299 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.497 HG12 ' O ' ' A' ' 48' ' ' ALA . 32.3 pt -70.66 -28.5 34.58 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-O 120.884 0.373 . . . . 0.0 110.702 179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.434 ' NZ ' ' HB3' ' A' ' 52' ' ' LYS . 5.3 ttpm? -54.08 -29.55 44.89 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.947 -0.57 . . . . 0.0 110.913 -179.815 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 148.26 37.53 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.759 -0.734 . . . . 0.0 112.594 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.53 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 0.3 OUTLIER -133.96 97.79 3.98 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-O 121.817 0.818 . . . . 0.0 110.731 -179.954 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.1 mm? -75.61 -19.78 58.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.348 -0.842 . . . . 0.0 111.452 179.288 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.626 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -26.31 -54.68 0.2 Allowed Pre-proline 0 N--CA 1.468 0.446 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 -178.496 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 71.0 Cg_exo -50.43 -43.38 44.72 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 121.645 1.563 . . . . 0.0 112.037 179.157 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.47 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.8 -46.3 48.6 Favored Glycine 0 CA--C 1.507 -0.467 0 CA-C-N 115.95 -0.568 . . . . 0.0 113.364 179.098 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.54 -37.23 86.11 Favored 'General case' 0 C--N 1.312 -1.047 0 CA-C-N 115.0 -0.6 . . . . 0.0 111.519 -179.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.639 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.88 -31.07 71.8 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 121.128 0.49 . . . . 0.0 110.13 179.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.568 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.8 m-30 -77.15 -45.23 27.48 Favored 'General case' 0 CA--C 1.513 -0.475 0 CA-C-N 115.665 -0.698 . . . . 0.0 109.926 179.249 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.93 -38.95 87.13 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.716 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.673 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 18.6 t80 -71.18 -55.04 8.98 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 112.638 0.607 . . . . 0.0 112.638 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.795 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.7 OUTLIER -77.9 -23.34 48.72 Favored 'General case' 0 C--O 1.221 -0.434 0 N-CA-C 111.878 0.325 . . . . 0.0 111.878 -179.873 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.54 -28.99 50.48 Favored Glycine 0 CA--C 1.518 0.258 0 C-N-CA 119.867 -1.159 . . . . 0.0 111.652 179.352 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -91.66 -30.12 4.72 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.231 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 178.255 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.673 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -49.32 -49.84 68.26 Favored Pre-proline 0 C--N 1.327 -0.396 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.992 178.929 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.795 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 40.1 Cg_endo -64.83 -39.09 27.07 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.93 2.42 . . . . 0.0 112.01 -178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 5.4 tt -58.14 -54.81 42.76 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.695 -0.483 . . . . 0.0 109.695 179.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 4.6 mm? -56.52 -50.8 70.75 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.767 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.449 HD13 ' HB1' ' A' ' 30' ' ' ALA . 72.0 mt -51.0 -51.09 56.49 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.351 0.407 . . . . 0.0 111.977 -179.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.59 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 8.8 tt -59.99 -40.4 89.0 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.684 0.278 . . . . 0.0 111.487 -179.54 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.2 tp -73.62 -40.52 63.73 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 112.733 0.642 . . . . 0.0 112.733 -178.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.1 pp -80.14 -28.47 38.87 Favored 'General case' 0 C--N 1.33 -0.248 0 C-N-CA 120.761 -0.376 . . . . 0.0 110.594 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.506 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -86.34 -3.1 58.93 Favored 'General case' 0 C--O 1.235 0.307 0 CA-C-O 121.263 0.554 . . . . 0.0 109.518 178.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.59 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 8.4 tp -78.82 145.19 65.78 Favored Pre-proline 0 C--O 1.232 0.168 0 CA-C-N 115.017 -0.992 . . . . 0.0 110.092 179.35 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.571 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 54.5 Cg_exo -51.91 155.99 7.65 Favored 'Trans proline' 0 C--N 1.348 0.501 0 C-N-CA 121.829 1.686 . . . . 0.0 110.858 178.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.413 ' HA ' ' CD1' ' A' ' 81' ' ' TYR . 46.0 Cg_exo -55.06 -58.13 1.34 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 121.888 1.725 . . . . 0.0 113.066 -179.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 12.3 ptp180 -62.64 -27.28 69.11 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.917 0.389 . . . . 0.0 111.238 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.19 -45.77 31.66 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.976 -179.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.495 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.5 OUTLIER -78.22 -22.54 48.34 Favored 'General case' 0 C--N 1.331 -0.199 0 C-N-CA 120.609 -0.436 . . . . 0.0 110.688 -178.8 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -71.22 -44.53 65.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.385 179.361 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -69.91 -16.72 63.27 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.028 -0.533 . . . . 0.0 110.735 179.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -81.85 -15.99 52.26 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.934 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -87.73 137.17 32.57 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.091 -0.504 . . . . 0.0 111.135 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 53.3 m . . . . . 0 C--O 1.25 1.114 0 CA-C-O 118.295 -0.859 . . . . 0.0 110.911 -179.947 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.869 0 N-CA-C 111.209 -0.343 . . . . 0.0 111.209 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.444 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 71.3 mt -71.6 -18.71 62.2 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.235 -179.887 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.84 -33.61 59.96 Favored Glycine 0 CA--C 1.522 0.498 0 C-N-CA 120.986 -0.626 . . . . 0.0 113.466 -179.706 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.586 ' HB2' ' HD3' ' A' ' 6' ' ' PRO . 71.0 m -60.58 -50.42 85.54 Favored Pre-proline 0 CA--C 1.537 0.447 0 N-CA-C 112.639 0.607 . . . . 0.0 112.639 -178.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.586 ' HD3' ' HB2' ' A' ' 5' ' ' SER . 27.3 Cg_exo -62.47 -50.09 4.94 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 122.125 1.884 . . . . 0.0 113.12 -179.605 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -60.19 -38.1 82.22 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.702 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -75.09 -39.26 60.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.767 0.317 . . . . 0.0 111.163 -179.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -64.87 -41.38 95.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.325 -0.398 . . . . 0.0 110.736 179.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.4 -37.1 84.46 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.016 -0.538 . . . . 0.0 110.831 179.838 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.0 ttm -68.0 -34.18 76.01 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.685 179.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -63.94 -41.7 97.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.41 179.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -60.62 -36.34 78.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.976 -0.557 . . . . 0.0 110.315 179.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.6 tppp? -69.41 -40.82 77.09 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.996 -0.547 . . . . 0.0 110.839 179.943 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -66.43 -46.64 75.79 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.192 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -66.14 -27.61 68.16 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.236 -179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -77.32 -43.2 33.93 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.941 -179.909 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -68.47 -33.52 74.3 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.009 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.7 ttpp -69.47 -38.29 77.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.286 -0.416 . . . . 0.0 110.866 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.58 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.26 -53.98 36.03 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.822 179.841 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.57 -49.25 68.12 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.785 -179.33 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.46 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.8 pt-20 -64.35 -31.53 72.77 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.003 0.43 . . . . 0.0 111.057 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.586 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -66.43 -54.1 28.02 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.38 -0.373 . . . . 0.0 111.167 179.977 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.58 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 1.0 OUTLIER -53.58 -50.08 66.37 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 112.219 0.452 . . . . 0.0 112.219 -179.422 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.46 HG22 ' O ' ' A' ' 22' ' ' GLU . 35.5 m -53.83 -44.98 62.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -177.468 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.28 -37.25 31.44 Favored 'Isoleucine or valine' 0 C--O 1.233 0.213 0 CA-C-O 120.759 0.314 . . . . 0.0 111.125 179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.586 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 93.0 mt -66.83 -20.41 65.93 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 121.102 0.477 . . . . 0.0 109.889 179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -70.79 -31.21 67.9 Favored 'General case' 0 CA--C 1.519 -0.238 0 N-CA-C 109.035 -0.728 . . . . 0.0 109.035 178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.739 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.95 -33.78 66.1 Favored 'General case' 0 N--CA 1.452 -0.335 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.251 178.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.48 -41.53 76.04 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 177.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 40.8 t -66.25 -40.53 90.26 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.204 -0.907 . . . . 0.0 110.083 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.739 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -63.39 -38.79 83.09 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.342 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 178.72 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -61.26 -41.39 96.85 Favored 'General case' 0 C--O 1.232 0.148 0 CA-C-N 115.395 -0.821 . . . . 0.0 110.31 178.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.475 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.3 -49.73 71.57 Favored Glycine 0 C--N 1.332 0.345 0 N-CA-C 110.915 -0.874 . . . . 0.0 110.915 178.732 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.607 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.96 -20.71 65.94 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.133 -0.533 . . . . 0.0 110.164 178.217 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.47 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.5 m-70 -74.94 -33.3 61.93 Favored 'General case' 0 CA--C 1.5 -0.951 0 N-CA-C 107.674 -1.232 . . . . 0.0 107.674 179.157 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.618 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.81 -33.3 60.32 Favored Glycine 0 N--CA 1.431 -1.673 0 CA-C-N 113.98 -1.464 . . . . 0.0 110.393 178.76 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.607 HG22 ' O ' ' A' ' 35' ' ' ALA . 13.1 tt -78.05 -35.59 20.51 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.211 0 C-N-CA 120.873 -0.331 . . . . 0.0 110.695 -179.744 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.855 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -76.8 -37.57 55.54 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 111.974 0.361 . . . . 0.0 111.974 -179.273 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.855 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.5 OUTLIER -73.06 -33.24 65.55 Favored 'General case' 0 CA--C 1.512 -0.514 0 CA-C-O 120.851 0.358 . . . . 0.0 111.024 -179.107 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.625 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 15.5 m-30 -79.48 -35.39 40.3 Favored 'General case' 0 C--N 1.315 -0.904 0 C-N-CA 120.311 -0.556 . . . . 0.0 109.927 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.544 HD13 ' O ' ' A' ' 38' ' ' ILE . 1.3 mp -56.36 -46.18 80.12 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 8.6 p -72.04 -46.11 60.6 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.926 0 CA-C-N 115.09 -0.959 . . . . 0.0 112.1 -179.097 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.439 ' HB2' ' O ' ' A' ' 40' ' ' SER . 1.5 m-85 -76.52 -54.37 6.8 Favored 'General case' 0 CA--C 1.551 0.996 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 -178.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.702 ' HB3' ' HG3' ' A' ' 57' ' ' PRO . 11.1 m-85 -77.31 -48.78 16.49 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 115.093 1.516 . . . . 0.0 115.093 -176.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.501 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 49.0 t -56.05 -81.87 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.742 0 C-N-CA 119.761 -0.776 . . . . 0.0 111.763 -175.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 42.63 -143.42 0.09 Allowed 'General case' 0 C--N 1.332 -0.183 0 N-CA-C 109.797 -0.445 . . . . 0.0 109.797 -179.003 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.96 12.83 9.74 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 120.887 0.375 . . . . 0.0 110.549 178.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.618 ' HB3' HH21 ' A' ' 54' ' ' ARG . 25.8 m95 -90.66 -32.44 16.22 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.584 -179.817 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.439 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.4 p90 -63.96 -11.7 30.98 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.818 0.342 . . . . 0.0 111.313 -179.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 24.6 pt -65.25 -27.59 42.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.12 -0.491 . . . . 0.0 111.658 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HG3' ' N ' ' A' ' 53' ' ' GLY . 22.2 ptmt -52.67 -43.26 65.41 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-N 116.489 -0.323 . . . . 0.0 111.179 -178.892 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.402 ' N ' ' HG3' ' A' ' 52' ' ' LYS . . . 157.43 38.74 0.02 OUTLIER Glycine 0 N--CA 1.449 -0.49 0 C-N-CA 120.254 -0.974 . . . . 0.0 112.997 179.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.618 HH21 ' HB3' ' A' ' 49' ' ' TRP . 16.0 ptt180 -132.29 102.4 5.75 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 121.508 0.671 . . . . 0.0 111.492 179.699 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' O ' ' N ' ' A' ' 58' ' ' GLY . 35.0 mt -73.32 -17.48 61.3 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.501 -0.772 . . . . 0.0 110.048 178.551 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.606 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -24.98 -52.55 0.16 Allowed Pre-proline 0 N--CA 1.465 0.302 0 O-C-N 123.768 0.667 . . . . 0.0 112.52 -178.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.702 ' HG3' ' HB3' ' A' ' 45' ' ' PHE . 89.8 Cg_exo -48.25 -51.16 10.59 Favored 'Trans proline' 0 C--N 1.353 0.815 0 C-N-CA 121.35 1.367 . . . . 0.0 111.798 178.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.441 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -48.82 -49.17 29.1 Favored Glycine 0 CA--C 1.509 -0.34 0 CA-C-N 115.978 -0.556 . . . . 0.0 113.896 179.556 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -62.62 -43.09 99.7 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 115.063 -0.568 . . . . 0.0 111.776 -179.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.625 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -59.78 -35.22 74.18 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.279 0.562 . . . . 0.0 110.219 179.281 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.643 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.3 m-30 -73.45 -45.79 52.22 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.366 -0.833 . . . . 0.0 110.119 179.442 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -65.54 -38.32 89.29 Favored 'General case' 0 N--CA 1.447 -0.594 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.8 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.675 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 10.5 m-85 -71.39 -54.49 10.54 Favored 'General case' 0 C--N 1.328 -0.337 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 -178.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.823 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.3 OUTLIER -77.69 -24.02 49.4 Favored 'General case' 0 C--O 1.222 -0.377 0 N-CA-C 111.837 0.31 . . . . 0.0 111.837 -179.737 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.516 ' HA3' HD12 ' A' ' 38' ' ' ILE . . . -78.99 -31.67 42.52 Favored Glycine 0 CA--C 1.516 0.147 0 C-N-CA 120.219 -0.991 . . . . 0.0 111.481 179.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -89.93 -27.44 5.16 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.161 0 N-CA-C 108.961 -0.755 . . . . 0.0 108.961 178.139 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.675 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.28 -51.75 60.41 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-N 114.761 -1.109 . . . . 0.0 110.95 178.795 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.823 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 36.7 Cg_endo -62.37 -42.95 25.05 Favored 'Trans proline' 0 N--CA 1.446 -1.276 0 C-N-CA 123.157 2.571 . . . . 0.0 112.143 -178.5 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.44 ' O ' HD13 ' A' ' 73' ' ' LEU . 1.6 tm? -57.17 -55.31 36.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.586 -179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 88.2 mt -57.89 -55.3 36.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.968 -0.56 . . . . 0.0 112.399 -179.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.655 HD12 ' N ' ' A' ' 72' ' ' LEU . 4.3 pp -55.16 -38.35 68.16 Favored 'General case' 0 C--O 1.224 -0.26 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -178.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.655 ' N ' HD12 ' A' ' 71' ' ' LEU . 47.6 tp -66.83 -44.42 81.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.688 0.28 . . . . 0.0 111.057 -179.835 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.44 HD13 ' O ' ' A' ' 69' ' ' LEU . 10.8 mp -70.97 -36.65 72.62 Favored 'General case' 0 N--CA 1.464 0.26 0 N-CA-C 112.383 0.512 . . . . 0.0 112.383 -179.131 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.9 pp -82.53 -23.82 34.37 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.113 179.705 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -89.42 -5.82 57.08 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 109.373 -0.603 . . . . 0.0 109.373 177.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.56 HD12 ' HD2' ' A' ' 77' ' ' PRO . 19.2 tp -108.02 135.01 19.92 Favored Pre-proline 0 C--O 1.232 0.177 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.919 179.316 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.56 ' HD2' HD12 ' A' ' 76' ' ' LEU . 83.4 Cg_exo -45.12 141.21 6.81 Favored 'Trans proline' 0 C--N 1.35 0.648 0 C-N-CA 122.305 2.003 . . . . 0.0 112.083 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.465 ' HA ' ' HD1' ' A' ' 81' ' ' TYR . 53.1 Cg_exo -55.12 -41.76 75.46 Favored 'Trans proline' 0 C--N 1.35 0.612 0 C-N-CA 122.477 2.118 . . . . 0.0 112.721 -179.365 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 79.6 ttt180 -67.48 -26.81 66.55 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 121.012 0.434 . . . . 0.0 110.418 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.516 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -75.07 -50.35 16.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.626 -179.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.465 ' HD1' ' HA ' ' A' ' 78' ' ' PRO . 0.4 OUTLIER -72.74 -24.01 60.91 Favored 'General case' 0 N--CA 1.457 -0.111 0 CA-C-O 120.767 0.317 . . . . 0.0 111.019 -179.553 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -70.82 -49.94 40.91 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.279 -0.419 . . . . 0.0 110.876 179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.69 -15.28 63.47 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.124 -0.489 . . . . 0.0 111.112 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -84.78 -14.89 46.8 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.081 -179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -85.26 162.35 19.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.995 179.87 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 53.2 m . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.3 -0.857 . . . . 0.0 110.973 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo . . . . . 0 N--CA 1.482 0.852 0 N-CA-C 111.207 -0.343 . . . . 0.0 111.207 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 56.1 tp -70.95 -21.55 62.32 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.888 179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -72.76 -34.0 59.84 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.772 -0.728 . . . . 0.0 113.193 -179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.48 ' N ' ' HD2' ' A' ' 6' ' ' PRO . 48.2 t -54.58 -51.01 82.19 Favored Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 -178.832 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.48 ' HD2' ' N ' ' A' ' 5' ' ' SER . 39.6 Cg_endo -67.35 -28.91 39.01 Favored 'Trans proline' 0 C--N 1.351 0.709 0 C-N-CA 121.921 1.747 . . . . 0.0 112.805 -179.636 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.1 -50.97 62.2 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.521 -0.309 . . . . 0.0 111.32 -179.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -71.04 -31.16 67.53 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.172 -179.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.67 -40.16 76.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.265 -0.425 . . . . 0.0 111.372 -179.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.12 -36.87 72.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.176 -179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 15.8 tpt -66.58 -40.32 88.86 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.945 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -62.16 -32.12 72.69 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.776 -179.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 61.5 t80 -67.48 -39.95 85.27 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.568 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -67.34 -40.61 85.87 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-N 115.976 -0.556 . . . . 0.0 110.644 179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -66.41 -40.79 89.8 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.574 179.623 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -64.12 -40.62 96.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.014 -0.539 . . . . 0.0 110.396 179.661 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -68.89 -34.58 75.66 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.443 179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.519 ' HA ' HD23 ' A' ' 21' ' ' LEU . 16.2 t70 -67.18 -40.92 86.65 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.017 -0.538 . . . . 0.0 110.558 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.424 ' HB2' ' HZ2' ' A' ' 19' ' ' LYS . 10.5 mtmp? -66.74 -28.89 68.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.157 -0.474 . . . . 0.0 110.429 179.428 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.527 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -67.09 -56.62 9.26 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.187 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . 0.674 ' O ' HG13 ' A' ' 25' ' ' VAL . 1.7 pp -55.51 -39.89 71.07 Favored 'General case' 0 CA--C 1.51 -0.591 0 CA-C-O 120.835 0.35 . . . . 0.0 110.978 -179.77 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.605 ' N ' ' HG ' ' A' ' 21' ' ' LEU . 1.6 tt0 -69.38 -40.89 77.15 Favored 'General case' 0 N--CA 1.437 -1.079 0 CA-C-N 115.81 -0.632 . . . . 0.0 112.453 -176.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.613 ' O ' ' HG ' ' A' ' 27' ' ' LEU . 5.6 m-20 -65.7 -55.28 18.21 Favored 'General case' 0 C--N 1.324 -0.518 0 C-N-CA 120.751 -0.38 . . . . 0.0 111.476 -179.268 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 7.3 mt -52.41 -51.6 58.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 -179.051 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.674 HG13 ' O ' ' A' ' 21' ' ' LEU . 26.7 m -52.53 -44.55 45.22 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -177.215 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 62.4 t -76.34 -40.97 35.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.153 0 CA-C-O 120.687 0.279 . . . . 0.0 110.878 179.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.613 ' HG ' ' O ' ' A' ' 23' ' ' ASN . 86.0 mt -63.9 -21.35 66.42 Favored 'General case' 0 C--N 1.331 -0.198 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.021 179.592 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -69.5 -32.96 72.16 Favored 'General case' 0 CA--C 1.518 -0.272 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 178.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.698 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -72.33 -31.8 65.98 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.41 178.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.78 -44.0 71.02 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 109.411 -0.588 . . . . 0.0 109.411 177.547 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.415 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 38.6 t -65.05 -40.12 94.29 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.247 179.683 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.698 HG12 ' O ' ' A' ' 29' ' ' ALA . 1.0 OUTLIER -64.05 -40.59 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 179.08 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.96 -42.74 98.86 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.684 -0.689 . . . . 0.0 110.681 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.422 ' HA2' ' HD2' ' A' ' 64' ' ' TYR . . . -62.16 -49.6 73.34 Favored Glycine 0 C--N 1.332 0.359 0 N-CA-C 110.995 -0.842 . . . . 0.0 110.995 178.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.601 ' O ' HG22 ' A' ' 38' ' ' ILE . . . -66.4 -20.15 65.99 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.126 -0.537 . . . . 0.0 110.277 178.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.5 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.6 m-70 -76.57 -32.11 57.95 Favored 'General case' 0 CA--C 1.503 -0.85 0 N-CA-C 107.794 -1.187 . . . . 0.0 107.794 179.148 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.594 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -73.63 -32.57 59.29 Favored Glycine 0 N--CA 1.434 -1.483 0 CA-C-N 114.14 -1.391 . . . . 0.0 110.653 178.673 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.601 HG22 ' O ' ' A' ' 35' ' ' ALA . 15.0 tt -77.68 -36.74 23.2 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.214 0 C-N-CA 121.022 -0.271 . . . . 0.0 110.388 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.889 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.84 -37.62 58.84 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -179.139 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.889 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -69.88 -36.54 75.53 Favored 'General case' 0 CA--C 1.511 -0.541 0 CA-C-O 120.842 0.353 . . . . 0.0 111.061 -178.802 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.605 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 9.9 m-85 -79.53 -33.33 42.06 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.296 179.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.524 ' O ' ' HB3' ' A' ' 46' ' ' CYS . 1.1 mp -57.65 -47.34 82.53 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.759 0.79 . . . . 0.0 108.986 176.689 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.469 HG23 ' N ' ' A' ' 44' ' ' PHE . 30.1 m -72.49 -50.8 32.42 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.808 0 CA-C-N 115.347 -0.842 . . . . 0.0 112.329 -178.933 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.469 ' N ' HG23 ' A' ' 43' ' ' VAL . 36.7 t80 -77.08 -54.25 6.77 Favored 'General case' 0 CA--C 1.552 1.024 0 N-CA-C 115.649 1.722 . . . . 0.0 115.649 -177.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.523 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -74.02 -45.91 46.84 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 113.967 -1.469 . . . . 0.0 114.195 -175.666 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 40.8 t -60.04 -81.14 0.02 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.197 -179.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.72 -142.17 0.47 Allowed 'General case' 0 C--N 1.332 -0.18 0 N-CA-C 109.794 -0.447 . . . . 0.0 109.794 -178.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.487 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -122.23 11.37 10.1 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.037 0.446 . . . . 0.0 110.564 178.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.9 m95 -90.92 -28.21 18.24 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.827 -0.624 . . . . 0.0 111.032 179.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.487 ' HA ' ' HG2' ' A' ' 54' ' ' ARG . 1.2 p90 -67.23 -24.64 65.84 Favored 'General case' 0 C--N 1.332 -0.164 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.4 -179.155 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.487 HG12 ' O ' ' A' ' 48' ' ' ALA . 20.2 pt -66.37 -27.45 40.51 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.395 0 CA-C-O 120.957 0.408 . . . . 0.0 110.61 179.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -53.52 -52.35 59.91 Favored 'General case' 0 C--O 1.231 0.125 0 CA-C-N 115.802 -0.636 . . . . 0.0 111.12 -179.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 169.8 40.93 0.03 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 C-N-CA 120.298 -0.953 . . . . 0.0 113.179 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.487 ' HG2' ' HA ' ' A' ' 50' ' ' TYR . 19.8 ptp180 -144.18 101.46 3.72 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.595 0.712 . . . . 0.0 111.425 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.487 HD13 ' N ' ' A' ' 56' ' ' ALA . 0.0 OUTLIER -73.25 -17.96 61.28 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.247 -0.888 . . . . 0.0 111.094 179.35 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.598 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.24 -54.05 0.17 Allowed Pre-proline 0 N--CA 1.468 0.433 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -178.476 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.598 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 85.1 Cg_exo -47.84 -46.41 21.61 Favored 'Trans proline' 0 C--N 1.355 0.879 0 C-N-CA 121.321 1.348 . . . . 0.0 111.774 178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.455 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.39 -46.67 44.81 Favored Glycine 0 CA--C 1.507 -0.462 0 CA-C-N 115.991 -0.549 . . . . 0.0 113.496 179.104 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -64.01 -39.8 94.92 Favored 'General case' 0 C--N 1.313 -1.014 0 CA-C-N 114.939 -0.631 . . . . 0.0 111.542 -179.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.605 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -63.14 -34.82 78.45 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.155 -0.475 . . . . 0.0 109.962 178.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.592 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.1 m-30 -72.85 -44.53 61.27 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.57 -0.741 . . . . 0.0 109.656 179.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.43 -38.9 88.45 Favored 'General case' 0 N--CA 1.446 -0.635 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.857 179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.668 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 5.7 m-85 -71.22 -54.96 9.15 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 112.724 0.639 . . . . 0.0 112.724 -178.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.785 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.0 OUTLIER -77.76 -24.23 49.03 Favored 'General case' 0 C--O 1.223 -0.319 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -179.654 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.19 -31.09 43.63 Favored Glycine 0 N--CA 1.453 -0.226 0 C-N-CA 120.017 -1.087 . . . . 0.0 111.64 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.4 p -91.58 -26.78 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.46 0.071 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 178.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.668 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.84 -52.38 57.82 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.007 178.775 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.785 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 44.9 Cg_endo -64.76 -40.66 21.26 Favored 'Trans proline' 0 N--CA 1.448 -1.177 0 C-N-CA 123.02 2.48 . . . . 0.0 112.501 -177.877 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.406 HD22 ' HA ' ' A' ' 69' ' ' LEU . 0.9 OUTLIER -57.59 -55.65 32.12 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.902 0.382 . . . . 0.0 110.199 179.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 92.8 mt -56.6 -53.93 51.87 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.313 179.76 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 82.5 mt -49.99 -51.67 39.92 Favored 'General case' 0 C--N 1.331 -0.226 0 O-C-N 123.353 0.408 . . . . 0.0 111.839 -179.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.411 ' O ' ' CB ' ' A' ' 76' ' ' LEU . 65.1 tp -58.36 -46.83 85.54 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.849 0.314 . . . . 0.0 111.849 -179.42 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 15.3 tp -68.32 -38.11 81.24 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 112.711 0.634 . . . . 0.0 112.711 -178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 2.1 pp -81.91 -21.91 37.1 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.126 0.489 . . . . 0.0 110.122 179.739 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -92.55 -5.76 51.01 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.642 -0.708 . . . . 0.0 109.596 178.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.461 HD12 ' HD2' ' A' ' 77' ' ' PRO . 21.3 tp -116.76 138.17 24.36 Favored Pre-proline 0 CA--C 1.53 0.185 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.186 179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.461 ' HD2' HD12 ' A' ' 76' ' ' LEU . 54.2 Cg_exo -53.38 134.63 58.05 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 121.891 1.727 . . . . 0.0 111.465 179.136 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -53.06 -34.43 67.88 Favored 'Trans proline' 0 C--N 1.349 0.594 0 C-N-CA 122.635 2.224 . . . . 0.0 112.579 -179.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.408 ' NE ' ' HA ' ' A' ' 79' ' ' ARG . 7.6 tpm_? -67.45 -29.46 68.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.407 179.924 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.432 ' HB3' ' HG ' ' A' ' 76' ' ' LEU . . . -73.19 -54.53 8.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.851 -0.613 . . . . 0.0 111.191 179.808 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -64.48 -31.02 72.06 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.022 -179.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.65 -40.89 84.53 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.3 -0.409 . . . . 0.0 110.665 179.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.53 -15.78 63.66 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.904 179.715 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -79.98 -18.03 51.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.077 -0.511 . . . . 0.0 110.812 179.799 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -76.46 130.91 38.66 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.076 -0.511 . . . . 0.0 110.85 179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 47.6 t . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.188 -0.91 . . . . 0.0 111.009 -179.87 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 1.3 Cg_endo . . . . . 0 N--CA 1.483 0.896 0 N-CA-C 111.192 -0.349 . . . . 0.0 111.192 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.505 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 2.5 pt? -66.93 -18.56 65.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.031 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.74 -33.67 57.59 Favored Glycine 0 CA--C 1.52 0.395 0 C-N-CA 121.124 -0.56 . . . . 0.0 113.358 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.603 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 45.5 t -52.58 -50.83 78.32 Favored Pre-proline 0 CA--C 1.537 0.461 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -178.872 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 51.6 Cg_exo -55.52 -31.82 80.09 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 122.166 1.911 . . . . 0.0 112.743 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -63.16 -39.19 93.93 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.829 0.347 . . . . 0.0 110.992 179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 90.0 t80 -75.25 -42.0 56.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.11 -179.812 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.06 -44.68 96.16 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.31 -0.404 . . . . 0.0 111.049 -179.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -66.07 -34.35 77.87 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.012 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.3 ttp -68.59 -32.65 72.69 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.1 -0.5 . . . . 0.0 110.914 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -68.55 -36.92 79.46 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 116.191 -0.458 . . . . 0.0 110.828 179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -65.35 -42.85 92.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.807 -179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 tppp? -62.21 -48.73 78.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.052 -179.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 17.5 t70 -65.34 -30.38 71.21 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.196 -0.457 . . . . 0.0 110.994 -179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 t70 -70.98 -33.72 70.71 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.269 -0.423 . . . . 0.0 110.948 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -79.28 -37.1 38.62 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.162 -0.472 . . . . 0.0 110.857 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -67.37 -36.78 82.05 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.753 179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -70.17 -36.93 75.02 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.958 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.567 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -65.12 -52.24 56.53 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.305 -0.407 . . . . 0.0 110.992 179.926 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.92 -48.88 69.75 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.548 -179.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.466 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.4 pt-20 -65.29 -30.74 71.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.774 0.321 . . . . 0.0 111.085 -179.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.431 ' O ' HD13 ' A' ' 27' ' ' LEU . 85.6 m-20 -65.45 -47.9 74.57 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.747 0.308 . . . . 0.0 111.033 179.682 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.567 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 6.2 mt -58.36 -52.47 65.46 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.303 -0.408 . . . . 0.0 112.034 -179.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.466 HG22 ' O ' ' A' ' 22' ' ' GLU . 34.1 m -52.62 -45.63 48.15 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.319 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -177.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.403 ' N ' HG23 ' A' ' 25' ' ' VAL . 40.8 t -73.92 -44.75 50.78 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.193 0 CA-C-O 120.878 0.37 . . . . 0.0 110.889 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.489 HD21 ' O ' ' A' ' 75' ' ' ALA . 0.9 OUTLIER -61.24 -21.6 64.03 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.337 179.606 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.3 t30 -70.03 -32.69 70.97 Favored 'General case' 0 CA--C 1.518 -0.259 0 N-CA-C 109.05 -0.722 . . . . 0.0 109.05 178.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.714 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -71.83 -33.41 68.45 Favored 'General case' 0 N--CA 1.453 -0.319 0 CA-C-N 115.52 -0.763 . . . . 0.0 109.431 178.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.42 -41.3 76.55 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 177.412 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.43 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 33.5 t -66.14 -38.73 88.85 Favored 'General case' 0 N--CA 1.453 -0.292 0 CA-C-N 115.08 -0.964 . . . . 0.0 110.141 179.585 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.714 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.9 OUTLIER -66.65 -40.03 85.21 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.367 0 N-CA-C 109.449 -0.574 . . . . 0.0 109.449 179.017 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -60.73 -42.46 97.36 Favored 'General case' 0 C--O 1.232 0.181 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.306 178.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.423 ' HA2' ' CD2' ' A' ' 64' ' ' TYR . . . -62.54 -49.12 76.5 Favored Glycine 0 C--N 1.333 0.371 0 N-CA-C 110.753 -0.939 . . . . 0.0 110.753 178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.643 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.05 -22.24 66.94 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 114.984 -0.608 . . . . 0.0 110.023 178.287 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.475 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 9.7 m-70 -74.47 -33.14 62.8 Favored 'General case' 0 CA--C 1.502 -0.88 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.583 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.16 -34.31 61.44 Favored Glycine 0 N--CA 1.434 -1.476 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 179.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.643 HG22 ' HA ' ' A' ' 35' ' ' ALA . 18.2 tt -78.05 -35.94 20.97 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.206 0 C-N-CA 120.956 -0.298 . . . . 0.0 110.565 -179.91 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.905 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.51 -38.61 59.33 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 112.088 0.403 . . . . 0.0 112.088 -179.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.905 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -68.45 -39.15 81.57 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 120.803 0.335 . . . . 0.0 111.2 -178.848 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 10.7 m-85 -77.37 -32.82 55.19 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.606 179.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.655 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.77 -46.75 84.12 Favored 'General case' 0 N--CA 1.444 -0.75 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 176.413 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 99.2 t -69.96 -54.18 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.722 0 CA-C-N 115.062 -0.972 . . . . 0.0 112.028 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 16.7 m-85 -76.13 -54.35 6.96 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 115.899 1.814 . . . . 0.0 115.899 -177.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.505 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -75.37 -38.24 60.13 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 113.959 -1.473 . . . . 0.0 114.501 -175.449 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.539 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 8.0 t -70.34 16.35 0.08 Allowed 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 118.12 0.418 . . . . 0.0 111.904 -178.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.509 ' C ' ' H ' ' A' ' 49' ' ' TRP . . . -49.97 156.73 0.71 Allowed 'General case' 0 C--N 1.332 -0.194 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 178.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . 0.459 ' O ' HG12 ' A' ' 51' ' ' ILE . . . -61.53 7.43 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 112.29 0.478 . . . . 0.0 112.29 -178.9 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . 0.509 ' H ' ' C ' ' A' ' 47' ' ' ALA . 25.1 m95 -90.65 -24.43 20.49 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.679 0.276 . . . . 0.0 110.854 178.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER -67.55 -27.67 67.15 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.177 -179.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.459 HG12 ' O ' ' A' ' 48' ' ' ALA . 44.4 pt -68.19 -28.9 42.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-O 120.741 0.305 . . . . 0.0 110.809 179.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -54.37 -34.98 62.29 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.677 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 154.85 30.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.645 -0.788 . . . . 0.0 113.408 179.646 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.447 ' HG2' ' O ' ' A' ' 54' ' ' ARG . 2.4 ttm180 -127.11 98.85 5.46 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.752 0.787 . . . . 0.0 110.442 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.451 ' O ' ' N ' ' A' ' 58' ' ' GLY . 4.2 mm? -75.01 -18.89 60.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.778 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.588 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.25 -53.82 0.17 Allowed Pre-proline 0 CA--C 1.538 0.513 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -178.095 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.588 ' HD3' ' HB3' ' A' ' 56' ' ' ALA . 87.0 Cg_exo -48.35 -44.88 28.24 Favored 'Trans proline' 0 C--N 1.354 0.86 0 C-N-CA 121.639 1.559 . . . . 0.0 112.109 178.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.451 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.59 -47.61 44.82 Favored Glycine 0 CA--C 1.505 -0.555 0 CA-C-N 115.798 -0.637 . . . . 0.0 113.408 179.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.32 -36.42 83.98 Favored 'General case' 0 C--N 1.312 -1.037 0 CA-C-N 114.94 -0.63 . . . . 0.0 111.53 -179.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -65.01 -32.73 74.6 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.162 0.506 . . . . 0.0 110.054 178.944 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.655 ' CE1' HD22 ' A' ' 42' ' ' LEU . 3.6 m-85 -76.15 -46.49 28.38 Favored 'General case' 0 CA--C 1.513 -0.459 0 CA-C-N 115.531 -0.759 . . . . 0.0 110.195 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -66.27 -37.57 85.78 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.371 -0.831 . . . . 0.0 110.584 179.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.657 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 22.5 t80 -71.26 -55.65 7.65 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -178.843 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 0.8 OUTLIER -78.15 -23.56 47.69 Favored 'General case' 0 C--O 1.223 -0.329 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.674 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -78.82 -30.21 48.77 Favored Glycine 0 N--CA 1.453 -0.196 0 C-N-CA 120.014 -1.089 . . . . 0.0 111.605 179.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.6 p -91.27 -29.68 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.521 -0.173 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 178.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.657 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -48.52 -50.82 56.46 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-N 114.751 -1.113 . . . . 0.0 110.929 178.753 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 39.0 Cg_endo -64.47 -39.77 27.13 Favored 'Trans proline' 0 N--CA 1.449 -1.129 0 C-N-CA 123.02 2.48 . . . . 0.0 112.126 -178.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 tt -57.67 -54.8 42.83 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.959 -0.386 . . . . 0.0 109.959 179.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.9 mp -57.69 -52.73 64.24 Favored 'General case' 0 N--CA 1.463 0.193 0 CA-C-N 115.881 -0.6 . . . . 0.0 111.469 179.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 83.1 mt -50.54 -50.86 52.24 Favored 'General case' 0 C--N 1.331 -0.225 0 N-CA-C 111.947 0.351 . . . . 0.0 111.947 -179.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.544 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 49.9 tp -57.06 -44.73 83.32 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 120.614 0.245 . . . . 0.0 111.497 -179.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 54.0 mt -71.29 -38.32 71.8 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.789 0.663 . . . . 0.0 112.789 -178.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.7 pp -82.5 -19.69 38.25 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 120.991 0.424 . . . . 0.0 110.438 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.489 ' O ' HD21 ' A' ' 27' ' ' LEU . . . -94.86 -8.58 36.86 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.888 -0.596 . . . . 0.0 109.651 178.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.544 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 2.3 tp -78.55 145.29 67.13 Favored Pre-proline 0 C--O 1.231 0.111 0 CA-C-N 115.302 -0.863 . . . . 0.0 110.55 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.488 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 52.5 Cg_exo -54.85 153.9 23.26 Favored 'Trans proline' 0 C--N 1.348 0.512 0 C-N-CA 121.97 1.78 . . . . 0.0 111.24 178.958 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 78.5 Cg_exo -49.47 -57.09 2.55 Favored 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.164 1.909 . . . . 0.0 113.368 -179.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 63.2 mtt180 -62.56 -26.25 68.49 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.865 0.364 . . . . 0.0 111.135 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -75.24 -46.81 31.45 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.837 -179.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -77.58 -24.88 49.63 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 120.803 -0.359 . . . . 0.0 110.777 -178.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.71 -44.89 69.43 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.256 -0.429 . . . . 0.0 110.545 179.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -70.24 -16.44 63.04 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-N 116.015 -0.539 . . . . 0.0 110.967 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -83.58 -13.3 54.71 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.075 -0.511 . . . . 0.0 110.907 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -96.51 175.18 6.5 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.021 -0.536 . . . . 0.0 110.954 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 48.7 m . . . . . 0 C--O 1.25 1.11 0 CA-C-O 118.223 -0.894 . . . . 0.0 111.025 -179.933 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PRO . . . . . . . . . . . . . 2.4 Cg_endo . . . . . 0 N--CA 1.483 0.892 0 N-CA-C 111.008 -0.42 . . . . 0.0 111.008 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.467 ' O ' ' HD2' ' A' ' 6' ' ' PRO . 39.7 tp -71.54 -18.77 62.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 0.0 110.871 179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -73.3 -34.71 57.49 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 121.051 -0.595 . . . . 0.0 113.42 -179.744 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . 0.603 ' HB3' ' HD3' ' A' ' 6' ' ' PRO . 41.6 t -56.03 -50.85 84.98 Favored Pre-proline 0 CA--C 1.534 0.351 0 N-CA-C 112.238 0.458 . . . . 0.0 112.238 -178.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.603 ' HD3' ' HB3' ' A' ' 5' ' ' SER . 32.3 Cg_exo -58.57 -29.16 88.19 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 122.015 1.81 . . . . 0.0 112.534 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -66.22 -58.09 6.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.376 -0.374 . . . . 0.0 111.172 -179.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PHE . . . . . . . . . . . . . 86.6 t80 -60.89 -43.73 98.09 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.969 -179.743 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -58.94 -42.55 90.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.262 -0.427 . . . . 0.0 110.975 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -63.62 -40.37 96.74 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.99 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 89.7 mtp -63.77 -31.64 72.88 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.191 -0.459 . . . . 0.0 110.774 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -65.45 -39.7 92.35 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.077 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.7 m-85 -64.23 -48.2 76.71 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.198 -0.456 . . . . 0.0 111.292 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -58.8 -49.27 78.3 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.14 -179.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -60.91 -33.84 73.76 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.963 -179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -69.17 -35.95 76.84 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.916 -179.993 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -73.73 -34.83 64.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.984 179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -70.54 -43.14 70.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.894 179.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -64.35 -32.06 73.52 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.163 0.506 . . . . 0.0 110.287 179.673 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.566 ' O ' ' HG ' ' A' ' 24' ' ' LEU . . . -66.78 -53.32 34.28 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.874 179.611 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.25 -47.37 72.34 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 116.056 -0.52 . . . . 0.0 111.793 -179.508 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLU . . . . . 0.511 ' O ' HG22 ' A' ' 25' ' ' VAL . 12.2 pt-20 -64.45 -31.37 72.55 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.923 0.392 . . . . 0.0 111.027 -179.394 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ASN . . . . . 0.625 ' O ' HD13 ' A' ' 27' ' ' LEU . 6.4 m-20 -66.75 -53.14 36.33 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.771 179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.566 ' HG ' ' O ' ' A' ' 20' ' ' ALA . 5.0 mt -50.06 -52.16 36.71 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.511 HG22 ' O ' ' A' ' 22' ' ' GLU . 29.6 m -55.29 -40.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.431 0 N-CA-C 112.643 0.609 . . . . 0.0 112.643 -177.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.613 HG23 HD12 ' A' ' 27' ' ' LEU . 25.4 m -80.11 -40.66 20.49 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 C-N-CA 121.051 -0.259 . . . . 0.0 111.353 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.625 HD13 ' O ' ' A' ' 23' ' ' ASN . 11.0 mp -61.89 -27.14 68.59 Favored 'General case' 0 N--CA 1.462 0.151 0 N-CA-C 109.649 -0.5 . . . . 0.0 109.649 178.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -68.15 -39.09 82.74 Favored 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.375 179.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.693 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -69.08 -33.82 74.14 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-N 115.99 -0.55 . . . . 0.0 110.247 179.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.494 ' HB1' HD13 ' A' ' 71' ' ' LEU . . . -69.45 -43.85 72.44 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.29 0.567 . . . . 0.0 109.752 177.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . 0.403 ' HA ' ' CB ' ' A' ' 68' ' ' PRO . 35.2 t -65.28 -36.93 85.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.209 -0.905 . . . . 0.0 110.429 179.74 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.693 HG12 ' O ' ' A' ' 29' ' ' ALA . 0.7 OUTLIER -67.87 -43.3 86.11 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 CA-C-N 115.981 -0.554 . . . . 0.0 109.987 179.6 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.419 ' N ' ' CG1' ' A' ' 32' ' ' VAL . . . -60.73 -43.42 97.91 Favored 'General case' 0 C--N 1.333 -0.138 0 CA-C-N 115.84 -0.618 . . . . 0.0 110.915 179.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.43 ' HA3' ' HD3' ' A' ' 68' ' ' PRO . . . -62.04 -49.8 71.65 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.447 -0.882 . . . . 0.0 111.206 179.048 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.557 ' HA ' HG22 ' A' ' 38' ' ' ILE . . . -65.51 -21.26 66.6 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.085 -0.557 . . . . 0.0 110.215 178.294 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.469 ' HA ' ' HG ' ' A' ' 39' ' ' LEU . 7.7 m-70 -75.73 -32.7 60.14 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 179.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.578 ' HA3' ' CD2' ' A' ' 64' ' ' TYR . . . -72.86 -33.65 59.84 Favored Glycine 0 N--CA 1.436 -1.336 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.959 179.08 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' HA ' ' A' ' 35' ' ' ALA . 11.6 tt -77.75 -36.86 23.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.221 0 C-N-CA 120.952 -0.299 . . . . 0.0 110.52 -179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LEU . . . . . 0.895 HD12 ' N ' ' A' ' 40' ' ' SER . 4.0 pp -75.68 -37.19 59.76 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 112.281 0.474 . . . . 0.0 112.281 -179.225 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . 0.895 ' N ' HD12 ' A' ' 39' ' ' LEU . 0.6 OUTLIER -70.32 -38.57 74.96 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-O 120.865 0.364 . . . . 0.0 111.061 -178.92 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.637 ' CD2' ' HB1' ' A' ' 60' ' ' ALA . 11.7 m-85 -77.42 -33.56 54.87 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 116.045 -0.525 . . . . 0.0 110.54 179.874 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.548 HD22 ' CE1' ' A' ' 61' ' ' TYR . 0.4 OUTLIER -57.17 -47.2 81.79 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 176.308 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.5 t -70.01 -54.2 20.08 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 CA-C-N 115.021 -0.991 . . . . 0.0 112.138 -179.115 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 22.2 m-85 -76.42 -54.37 6.83 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.898 1.814 . . . . 0.0 115.898 -177.583 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.527 ' CD1' ' HG3' ' A' ' 57' ' ' PRO . 0.0 OUTLIER -73.92 -45.71 48.86 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 113.936 -1.484 . . . . 0.0 114.484 -175.232 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . 0.523 ' HB2' ' OH ' ' A' ' 61' ' ' TYR . 31.6 t -59.27 -81.01 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 120.536 -0.466 . . . . 0.0 111.463 -178.842 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . 47.49 -142.39 0.44 Allowed 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 109.953 -0.388 . . . . 0.0 109.953 -179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -122.11 9.08 9.84 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-O 120.948 0.404 . . . . 0.0 110.625 179.044 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TRP . . . . . . . . . . . . . 40.3 m95 -90.52 -25.19 20.38 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.001 -0.545 . . . . 0.0 111.072 179.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' TYR . . . . . 0.482 ' HA ' ' CG ' ' A' ' 54' ' ' ARG . 1.1 p90 -66.08 -26.69 67.6 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.217 -0.447 . . . . 0.0 111.216 -179.292 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 2.4 pp -68.43 -28.6 41.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-O 120.841 0.353 . . . . 0.0 110.671 179.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 25.0 ttmm -54.46 -52.34 62.15 Favored 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.143 -179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 172.6 42.22 0.04 OUTLIER Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.157 -1.02 . . . . 0.0 113.31 179.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.482 ' CG ' ' HA ' ' A' ' 50' ' ' TYR . 9.8 ptp180 -147.75 96.28 2.64 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.635 0.731 . . . . 0.0 111.546 179.366 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.512 ' CD1' ' H ' ' A' ' 55' ' ' LEU . 0.0 OUTLIER -71.41 -18.02 62.37 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.254 -0.884 . . . . 0.0 110.793 178.945 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.547 ' HB3' ' HD3' ' A' ' 57' ' ' PRO . . . -25.36 -52.41 0.17 Allowed Pre-proline 0 N--CA 1.469 0.479 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -178.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.58 ' HB3' ' OH ' ' A' ' 61' ' ' TYR . 86.1 Cg_exo -47.63 -45.18 24.29 Favored 'Trans proline' 0 C--N 1.356 0.921 0 C-N-CA 121.284 1.323 . . . . 0.0 111.944 178.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLY . . . . . 0.413 ' N ' ' O ' ' A' ' 55' ' ' LEU . . . -50.95 -48.89 44.24 Favored Glycine 0 CA--C 1.505 -0.551 0 CA-C-N 115.941 -0.572 . . . . 0.0 113.523 179.109 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -63.34 -37.68 88.23 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 114.938 -0.631 . . . . 0.0 111.373 -179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.637 ' HB1' ' CD2' ' A' ' 41' ' ' PHE . . . -64.2 -33.97 77.02 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-N 116.034 -0.53 . . . . 0.0 110.212 179.217 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . 0.58 ' OH ' ' HB3' ' A' ' 57' ' ' PRO . 3.7 m-85 -74.53 -43.21 56.9 Favored 'General case' 0 CA--C 1.511 -0.52 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.812 178.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -68.09 -39.2 82.91 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.023 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.666 ' O ' ' HB2' ' A' ' 67' ' ' TRP . 8.0 m-85 -71.13 -54.77 9.89 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.476 0.547 . . . . 0.0 112.476 -178.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.796 ' O ' ' HD3' ' A' ' 68' ' ' PRO . 1.4 m-85 -77.85 -23.6 48.86 Favored 'General case' 0 C--O 1.22 -0.461 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -79.58 -29.49 48.33 Favored Glycine 0 CA--C 1.519 0.286 0 C-N-CA 119.888 -1.148 . . . . 0.0 111.617 179.267 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 1.8 p -92.01 -28.5 4.65 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.131 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 178.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.666 ' HB2' ' O ' ' A' ' 63' ' ' PHE . 0.0 OUTLIER -50.7 -50.44 73.15 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 114.944 -1.026 . . . . 0.0 111.048 178.754 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.796 ' HD3' ' O ' ' A' ' 64' ' ' TYR . 45.6 Cg_endo -65.18 -38.93 25.34 Favored 'Trans proline' 0 N--CA 1.451 -1.001 0 C-N-CA 123.082 2.522 . . . . 0.0 112.171 -178.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.463 ' O ' HD23 ' A' ' 73' ' ' LEU . 1.7 tm? -57.55 -56.49 21.18 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mp -56.64 -50.73 71.18 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.085 179.327 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.494 HD13 ' HB1' ' A' ' 30' ' ' ALA . 63.6 mt -49.82 -53.43 25.48 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 112.254 0.464 . . . . 0.0 112.254 -179.153 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.556 ' O ' ' HB2' ' A' ' 76' ' ' LEU . 9.7 tt -57.21 -42.99 82.39 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.542 0.21 . . . . 0.0 111.482 -179.559 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.463 HD23 ' O ' ' A' ' 69' ' ' LEU . 4.6 mm? -72.02 -38.2 69.64 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 112.811 0.671 . . . . 0.0 112.811 -178.809 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -82.65 -20.74 35.68 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.406 179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ALA . . . . . 0.56 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -93.25 -4.74 51.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.39 0.614 . . . . 0.0 109.464 178.42 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.556 ' HB2' ' O ' ' A' ' 72' ' ' LEU . 10.3 tp -78.88 144.14 63.46 Favored Pre-proline 0 CA--C 1.529 0.156 0 CA-C-N 114.986 -1.006 . . . . 0.0 110.103 179.408 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.527 ' HD2' ' HG ' ' A' ' 76' ' ' LEU . 62.6 Cg_exo -50.89 152.2 10.29 Favored 'Trans proline' 0 C--N 1.35 0.622 0 C-N-CA 121.883 1.722 . . . . 0.0 111.118 179.061 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PRO . . . . . 0.419 ' HA ' ' CD2' ' A' ' 81' ' ' TYR . 64.6 Cg_exo -50.23 -60.3 0.88 Allowed 'Trans proline' 0 CA--C 1.528 0.197 0 C-N-CA 122.185 1.923 . . . . 0.0 113.528 -178.733 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -63.12 -25.23 68.26 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 120.869 0.366 . . . . 0.0 111.259 -179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -76.59 -44.37 34.74 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.218 -0.447 . . . . 0.0 111.864 -179.545 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' TYR . . . . . 0.453 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . 0.6 OUTLIER -78.72 -25.22 44.63 Favored 'General case' 0 N--CA 1.456 -0.13 0 C-N-CA 120.671 -0.412 . . . . 0.0 110.518 -178.96 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -69.18 -44.59 71.89 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.117 -0.492 . . . . 0.0 110.162 179.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -68.6 -20.71 64.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.857 -0.61 . . . . 0.0 110.815 179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -75.04 -20.74 59.45 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.994 179.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -81.22 121.79 26.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.095 -0.502 . . . . 0.0 110.962 179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 46.6 t . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.338 -0.839 . . . . 0.0 111.027 -179.851 . . . . . . . . 0 0 . 1 stop_ save_