data_2lgw_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 2lgw _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.622 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 30.2 t80 -59.13 -35.34 73.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -177.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -56.82 -42.61 79.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.139 0.495 . . . . 0.0 110.21 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -74.63 -45.09 47.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.928 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.766 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.2 pp -72.8 -40.88 61.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -167.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.438 ' HB3' ' H ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -101.67 -106.08 0.25 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.322 -169.127 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.471 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 26.6 t70 -140.53 -35.71 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.84 -171.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 31.6 m -129.79 162.08 55.62 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.693 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.539 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.8 Cg_endo -62.11 160.78 28.84 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.589 2.859 . . . . 0.0 113.108 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.6 106.74 11.85 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.909 0.861 . . . . 0.0 109.182 175.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -176.65 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 145.59 47.35 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.086 173.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -68.08 165.74 17.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.19 -177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.88 -30.11 22.66 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.074 0.464 . . . . 0.0 111.843 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.5 -44.39 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -68.84 -34.99 76.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.212 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.62 HG13 ' CZ ' ' A' ' 4' ' ' TYR . 1.9 mp -57.54 -47.8 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.673 176.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -65.83 -38.29 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.056 0.455 . . . . 0.0 110.126 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 1.2 tmtt? -69.68 -35.42 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.733 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.552 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -63.85 -35.86 82.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 110.462 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.539 ' HD1' HG23 ' A' ' 49' ' ' VAL . 4.1 t80 -64.01 -48.04 77.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.188 173.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 71.9 mtp180 -64.68 -43.25 94.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.357 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 8.9 ptp85 -65.21 -39.96 93.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.719 0.295 . . . . 0.0 110.439 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.466 ' HA ' ' HB3' ' A' ' 29' ' ' GLN . 24.1 ttmm -71.73 -35.81 70.27 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.573 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.87 -44.96 74.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.189 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 10.7 mp -71.48 -34.81 70.51 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.782 175.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.466 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 33.5 tt0 -61.66 -36.82 81.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.393 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.517 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 95.3 m95 -111.85 19.35 18.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.342 0.592 . . . . 0.0 110.82 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.617 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 27.7 t60 -72.14 145.04 88.07 Favored Pre-proline 0 C--N 1.322 -0.61 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.617 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.4 Cg_endo -54.21 -28.73 53.36 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.866 3.044 . . . . 0.0 113.633 -174.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.38 -25.17 65.83 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.123 0.487 . . . . 0.0 110.134 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HB2' ' HZ2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -108.72 2.59 21.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.117 -175.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -104.04 140.29 20.93 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 120.939 0.399 . . . . 0.0 110.216 -176.108 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -87.34 -119.52 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.047 2.498 . . . . 0.0 112.757 -178.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -86.91 -8.05 57.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.114 0.483 . . . . 0.0 111.157 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.572 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 55.1 m-80 -102.47 102.95 13.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.242 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.541 ' HG3' HD22 ' A' ' 35' ' ' ASN . 0.1 OUTLIER -97.77 -31.07 12.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.949 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -61.75 -44.88 96.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.205 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.572 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 82.6 m-85 -66.79 -37.43 84.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.448 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -68.15 -45.99 72.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.029 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.3 pt-20 -70.3 -36.22 74.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.546 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 ttmm -59.53 -44.44 93.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 120.864 0.364 . . . . 0.0 110.147 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 62.9 mmtt -68.12 -39.64 82.72 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -62.44 -41.59 98.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.377 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.34 -44.11 76.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.749 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.518 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 12.7 pt-20 -72.27 -36.28 68.97 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.539 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.8 p -67.21 -38.38 80.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.085 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.84 -44.46 96.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 11.5 pt-20 -72.7 -40.66 66.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.967 0.413 . . . . 0.0 111.083 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.766 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -72.04 -40.03 68.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.454 -175.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.507 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -69.28 -34.23 74.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 175.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.46 -50.26 74.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.901 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.585 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 3.2 m -67.93 -40.98 84.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 62' ' ' ARG . 31.1 tp -73.1 -28.83 62.5 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.169 -0.612 . . . . 0.0 112.06 -175.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.9 t -77.98 -22.63 49.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.784 0.326 . . . . 0.0 110.228 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.833 ' HB3' ' HG3' ' A' ' 61' ' ' LYS . 11.7 t70 -112.41 121.67 45.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.082 0.468 . . . . 0.0 109.747 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.501 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 3.0 mptp? -66.56 -34.99 79.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.005 -170.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.498 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.5 t-80 -69.68 -42.16 74.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.517 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.833 ' HG3' ' HB3' ' A' ' 58' ' ' ASP . 4.6 mtpt -60.49 -33.76 73.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.623 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 14.9 mtm105 -60.63 -46.67 89.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.03 0.443 . . . . 0.0 110.654 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 14.8 pt-20 -71.84 -30.12 65.13 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.592 -176.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.789 HD12 ' HD3' ' A' ' 67' ' ' ARG . 47.8 mm -63.65 -38.02 81.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -65.24 -39.92 93.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.277 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -72.83 -45.73 56.8 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.789 ' HD3' HD12 ' A' ' 64' ' ' ILE . 9.0 ptm180 -71.61 -41.71 68.56 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 122.33 -0.231 . . . . 0.0 111.388 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.01 -0.46 57.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.512 0.673 . . . . 0.0 109.773 -174.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.59 -48.76 8.66 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 166.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -65.75 -45.51 82.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.431 -0.885 . . . . 0.0 111.585 175.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.953 179.146 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.477 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -61.32 -36.85 81.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.862 -178.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.539 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 2.1 p90 -57.35 -39.3 75.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.153 175.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.539 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 8.0 mm-40 -73.88 -44.36 55.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.463 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.674 HD12 HD11 ' A' ' 56' ' ' LEU . 2.3 pp -71.15 -31.73 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.715 -173.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.7 tp -97.39 -78.37 0.48 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.801 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 177.56 -44.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.251 0.548 . . . . 0.0 110.222 -175.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 27.5 m -120.5 156.14 55.92 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.642 -170.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.521 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 87.1 Cg_endo -81.74 174.66 10.13 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.201 2.6 . . . . 0.0 112.042 176.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 ptm85 -78.05 -8.92 58.82 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.392 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 m -69.35 -13.85 62.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.082 0.467 . . . . 0.0 110.776 176.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.98 144.27 28.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.6 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 m -72.74 163.59 27.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.738 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.28 -40.14 61.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -173.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.15 -34.52 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.358 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.415 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 21.1 t70 -69.66 -40.03 76.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.448 ' H ' HD12 ' A' ' 19' ' ' ILE . 2.3 mp -61.81 -40.93 88.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.825 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.874 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 26.7 ttpp -57.59 -43.33 84.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.556 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.2 mmpt? -63.54 -35.98 82.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.537 174.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.55 -47.88 77.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.874 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 12.4 p90 -70.09 -36.93 75.26 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.894 -0.722 . . . . 0.0 109.849 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.42 ' O ' HD12 ' A' ' 28' ' ' LEU . 1.8 mmt180 -57.52 -45.7 84.69 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.893 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 6.3 ptp180 -67.07 -39.18 86.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.797 0.332 . . . . 0.0 110.514 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -64.76 -38.27 90.42 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.92 -36.27 80.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.074 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.457 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 6.4 mp -69.68 -36.21 75.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.404 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.23 -37.4 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.769 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -108.22 20.27 18.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.808 0.337 . . . . 0.0 111.064 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.522 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.2 t-80 -72.02 140.67 83.38 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.522 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 9.3 Cg_endo -53.07 -37.28 79.02 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.731 2.287 . . . . 0.0 113.327 -167.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -67.88 -26.49 66.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 111.162 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 12.9 mmtp -107.34 15.12 25.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.498 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -107.76 134.33 20.1 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.365 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -81.26 -120.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 122.951 2.434 . . . . 0.0 113.251 -175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -97.04 -9.33 28.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 111.613 -173.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.43 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.9 m120 -100.69 101.62 12.54 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.5 OUTLIER -93.53 -29.63 15.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.314 -174.581 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -54.43 -44.84 72.77 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.549 0.531 . . . . 0.0 110.979 -174.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 89.9 m-85 -62.61 -43.11 99.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.03 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.84 96.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.016 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 15.7 mt-10 -69.56 -44.14 71.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.024 0.44 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -64.98 -41.48 95.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.287 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 66.5 mmtt -71.69 -34.57 69.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.661 0.267 . . . . 0.0 110.333 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -60.76 -39.27 88.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.085 0.469 . . . . 0.0 109.751 174.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.94 -45.77 84.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.488 174.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -63.74 -43.93 95.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.467 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.482 ' CG2' ' HB2' ' A' ' 23' ' ' TYR . 11.2 p -67.35 -36.72 77.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.782 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . . . -63.87 -45.77 87.93 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.91 0.386 . . . . 0.0 111.74 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -70.69 -36.8 73.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.544 0.688 . . . . 0.0 109.979 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -73.97 -45.94 47.06 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.662 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.674 ' CD2' ' HA ' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.13 -34.77 78.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -51.24 68.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.322 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG13 ' HA ' ' A' ' 52' ' ' ALA . 14.6 p -71.84 -39.09 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.674 HD11 HD12 ' A' ' 7' ' ' ILE . 46.6 mt -68.47 -24.29 64.68 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -172.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.8 t -78.3 -23.11 47.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.907 0.385 . . . . 0.0 110.36 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -114.33 121.58 44.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.0 111.027 -177.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -65.28 -36.25 83.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.691 -178.064 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.457 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 32.2 m-70 -69.14 -41.86 76.76 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.853 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' A' ' 61' ' ' LYS . 26.7 ttmt -63.09 -33.78 76.18 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.07 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -62.13 -37.14 84.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.821 174.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 41.5 mt-10 -63.38 -43.08 98.62 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.114 0.483 . . . . 0.0 110.175 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.14 -44.93 95.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -66.19 -35.36 80.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.19 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.8 -47.38 69.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -82.67 -41.28 19.58 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -93.19 9.91 34.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.561 0.696 . . . . 0.0 110.112 -171.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -87.03 -47.59 4.68 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 169.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -66.7 -42.36 86.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.366 -0.917 . . . . 0.0 110.659 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 C--O 1.246 0.921 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 120.98 0.419 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.514 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.2 m-85 -68.5 -33.71 74.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.112 0.482 . . . . 0.0 110.458 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.79 -35.07 78.65 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.518 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -74.55 -43.97 53.23 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.138 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.655 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.6 pp -69.51 -40.96 80.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -174.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 32.6 tp -102.58 -104.02 0.28 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.011 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.596 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 7.2 m-20 -158.48 -22.65 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.125 -177.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.61 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.4 m -118.48 158.52 46.74 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.647 -176.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.61 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.3 Cg_endo -59.3 -81.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.079 2.519 . . . . 0.0 114.118 -172.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.458 ' HA ' HD11 ' A' ' 56' ' ' LEU . 37.8 ptt180 -171.32 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -177.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.5 t -97.25 27.41 4.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.304 0.573 . . . . 0.0 110.455 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.519 ' HB3' HD13 ' A' ' 19' ' ' ILE . . . -81.44 145.92 30.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.497 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.5 m -55.37 128.58 34.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . 0.595 ' O ' ' HG2' ' A' ' 20' ' ' LYS . . . -53.23 -33.75 54.22 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -170.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.75 -34.8 77.95 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.878 0.371 . . . . 0.0 110.753 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.82 -35.81 77.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.754 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.83 HG22 ' HB2' ' A' ' 57' ' ' SER . 2.4 mp -59.72 -42.68 89.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.733 170.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.595 ' HG2' ' O ' ' A' ' 16' ' ' ALA . 71.0 mmtt -61.22 -37.91 84.72 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.562 175.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.596 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.63 -47.44 78.54 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.26 176.749 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HB1' ' HB2' ' A' ' 9' ' ' ASP . . . -60.63 -39.57 88.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.136 0.494 . . . . 0.0 110.466 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.689 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -67.57 -50.0 60.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.486 176.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtt85 -68.36 -37.78 80.79 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 25' ' ' ARG . 8.4 ttt-85 -62.12 -44.44 96.64 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.973 0.416 . . . . 0.0 110.742 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.612 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.2 ttmm -66.46 -42.34 87.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 110.078 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.99 84.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.293 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.435 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -66.86 -37.05 83.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.538 -177.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -64.12 -34.82 78.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 0.0 110.925 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -106.45 19.3 20.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.288 0.566 . . . . 0.0 110.546 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.508 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.27 152.2 94.38 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.356 -178.427 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.508 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.1 Cg_endo -54.81 -30.09 66.01 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.492 2.128 . . . . 0.0 112.074 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.8 -24.38 62.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.899 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -115.43 -3.42 12.42 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -173.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.421 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 29.9 p30 -103.54 140.25 20.88 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.262 0.554 . . . . 0.0 110.458 -176.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 55.5 Cg_endo -92.19 -104.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.155 2.57 . . . . 0.0 112.85 -177.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -98.12 -7.21 30.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.84 0.352 . . . . 0.0 111.854 -176.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -94.34 100.91 12.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 0.0 110.182 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -101.63 -29.54 11.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.52 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.85 -43.6 90.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.227 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -71.02 -37.48 72.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.627 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.5 -43.87 95.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.949 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 10.2 pt-20 -69.55 -38.94 77.68 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.323 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -59.76 -47.8 84.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.684 0.278 . . . . 0.0 110.949 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.488 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 67.1 mmtt -65.09 -35.22 80.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.687 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -67.08 -40.73 87.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.475 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 88.2 mttt -68.36 -46.52 69.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 11.9 pt-20 -67.29 -37.49 83.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.376 -175.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.689 HG23 ' HD1' ' A' ' 23' ' ' TYR . 14.7 p -71.8 -37.72 63.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.334 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -44.37 94.59 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.336 -178.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.96 -40.92 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.19 0.519 . . . . 0.0 110.603 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.655 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -75.2 -38.93 60.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.083 -175.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.5 -35.75 68.23 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.45 -45.55 90.35 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.399 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.724 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 11.1 p -70.23 -41.07 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.738 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.458 HD11 ' HA ' ' A' ' 12' ' ' ARG . 58.4 tp -74.31 -30.93 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' SER . . . . . 0.83 ' HB2' HG22 ' A' ' 19' ' ' ILE . 32.1 t -81.72 -21.17 38.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.731 0.301 . . . . 0.0 110.98 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.535 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 20.2 t70 -111.83 124.46 52.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 -174.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -66.93 -32.19 73.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.489 ' O ' HG12 ' A' ' 64' ' ' ILE . 43.0 m-70 -68.39 -41.89 79.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 177.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.724 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 5.9 mptp? -61.51 -36.71 81.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.568 174.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 46.8 mmm-85 -59.94 -40.8 90.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.059 0.457 . . . . 0.0 109.842 174.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.51 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 44.1 mt-10 -65.22 -40.17 93.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.996 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 60' ' ' HIS . 42.4 mm -64.43 -44.45 97.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.776 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.05 -37.33 87.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.914 0.388 . . . . 0.0 110.501 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.08 -45.09 95.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -88.73 -48.05 7.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -94.64 -9.74 34.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.861 0.362 . . . . 0.0 111.248 -170.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.16 -44.63 97.46 Favored Glycine 0 CA--C 1.506 -0.479 0 N-CA-C 111.198 -0.761 . . . . 0.0 111.198 175.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -66.7 -34.28 77.5 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.25 -0.975 . . . . 0.0 111.559 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.957 -177.569 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 121.411 0.625 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.554 ' HA ' HG13 ' A' ' 7' ' ' ILE . 98.7 m-85 -68.79 -23.86 64.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.559 176.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -56.59 -33.01 65.8 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.0 -44.37 61.11 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.411 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.809 HD12 ' HB2' ' A' ' 52' ' ' ALA . 2.7 pp -71.8 -39.18 67.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.826 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.48 ' N ' HD13 ' A' ' 7' ' ' ILE . 38.4 tp -100.59 -90.56 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 171.1 -16.04 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.513 0.725 . . . . 0.0 109.924 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.98 152.46 56.48 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.975 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -87.59 165.49 7.76 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.907 2.405 . . . . 0.0 112.524 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.784 ' HB3' HD13 ' A' ' 56' ' ' LEU . 11.0 ptm180 -70.15 -3.91 18.98 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.472 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 t -56.02 -33.5 64.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.261 172.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.34 146.03 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.423 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.8 p -63.76 155.81 29.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.231 177.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.84 64.11 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -170.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.488 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 21.7 m-20 -62.7 -34.42 77.1 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.979 0.418 . . . . 0.0 111.346 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.41 -41.37 98.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.865 178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.441 HG23 HD22 ' A' ' 8' ' ' LEU . 1.9 mp -62.61 -39.19 83.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.6 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.488 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 90.9 mttt -58.24 -41.29 83.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.251 177.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -68.88 -36.01 77.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.509 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.42 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.34 -35.96 82.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.23 0.538 . . . . 0.0 110.075 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.817 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -65.67 -43.6 88.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.835 174.56 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -68.22 -38.51 81.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.764 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 4.0 ptm180 -69.37 -36.7 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.902 0.382 . . . . 0.0 110.488 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.504 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 21.2 ttmm -70.92 -42.48 69.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 121.163 0.506 . . . . 0.0 109.769 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.38 -45.82 84.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.946 176.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.71 -37.32 83.72 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.936 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -65.63 -31.19 72.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.337 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.449 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 98.6 m95 -105.4 13.37 30.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.069 0.461 . . . . 0.0 111.462 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -82.04 147.75 58.58 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 12.2 Cg_endo -54.25 -29.4 56.97 Favored 'Trans proline' 0 N--CA 1.477 0.501 0 C-N-CA 124.27 3.313 . . . . 0.0 113.625 -167.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -64.2 -30.59 71.64 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.105 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -111.56 7.55 20.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.505 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 27.0 t-20 -107.98 140.06 21.28 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.467 -176.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.453 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 91.4 Cg_endo -78.02 -117.76 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.863 2.375 . . . . 0.0 112.753 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.453 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 2.5 m-20 -97.11 -7.03 33.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.589 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 16.8 m120 -103.59 99.02 8.82 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.206 -173.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 32' ' ' PRO . 46.0 mmtm -93.06 -25.77 17.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.867 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 7.8 tm-20 -60.85 -44.08 97.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.666 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.589 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 54.7 m-85 -71.97 -37.83 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 175.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.505 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.87 -46.21 88.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.641 0.258 . . . . 0.0 111.184 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -69.32 -35.63 76.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 5.1 tttp -58.77 -48.43 81.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.629 177.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -72.01 -34.99 69.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.911 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.98 -40.19 92.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.243 0.544 . . . . 0.0 109.689 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -67.37 -45.87 75.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.467 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.79 -43.3 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.635 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.817 HG23 ' HD1' ' A' ' 23' ' ' TYR . 12.0 p -67.89 -37.4 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.909 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.73 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.775 0.322 . . . . 0.0 111.263 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.08 -36.85 69.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.078 0.466 . . . . 0.0 110.525 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.809 ' HB2' HD12 ' A' ' 7' ' ' ILE . . . -75.62 -38.53 58.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.091 -173.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -36.08 72.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -65.03 -47.08 78.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.612 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.606 ' HA ' ' CB ' ' A' ' 61' ' ' LYS . 11.8 p -64.68 -38.71 83.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.37 . . . . 0.0 111.145 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.784 HD13 ' HB3' ' A' ' 12' ' ' ARG . 48.1 tp -74.08 -29.15 61.72 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.7 t -84.19 -19.55 33.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.495 0.188 . . . . 0.0 111.205 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.595 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 23.3 t70 -112.36 129.99 56.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.383 0.611 . . . . 0.0 111.56 -174.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.658 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.69 -36.06 81.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.153 -175.425 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.4 ' O ' HD13 ' A' ' 64' ' ' ILE . 35.5 m170 -69.75 -41.89 74.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.128 0.49 . . . . 0.0 110.227 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.798 ' HA ' ' HE2' ' A' ' 61' ' ' LYS . 10.5 mmpt? -61.15 -37.76 84.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.603 176.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 89.0 mtt180 -61.77 -47.22 86.17 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.758 0.313 . . . . 0.0 111.427 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -71.39 -35.8 71.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.611 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.411 ' HA ' ' HG2' ' A' ' 67' ' ' ARG . 1.6 mp -65.11 -39.19 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.62 -38.02 83.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.401 . . . . 0.0 110.629 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -73.08 -47.72 42.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.453 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 64' ' ' ILE . 8.6 ptm180 -77.01 -30.93 56.06 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -173.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -94.85 -10.14 32.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.286 0.565 . . . . 0.0 110.053 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.64 -47.27 10.25 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.312 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -62.82 -27.64 69.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.003 -0.598 . . . . 0.0 111.832 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.464 -0.779 . . . . 0.0 111.376 -176.526 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.9 p . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.261 0.553 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.513 ' O ' HG13 ' A' ' 7' ' ' ILE . 57.2 m-85 -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.794 176.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.38 -32.7 73.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.427 176.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -73.36 -44.03 59.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.07 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.5 pp -70.22 -40.54 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.38 -176.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.424 HD23 ' HB2' ' A' ' 22' ' ' ALA . 20.2 tp -102.29 -93.08 0.31 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.401 ' H ' ' HB3' ' A' ' 8' ' ' LEU . 4.5 p30 174.27 3.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.021 0.826 . . . . 0.0 110.771 173.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.421 HG21 HD21 ' A' ' 8' ' ' LEU . 17.0 m -121.11 154.39 58.26 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-O 120.643 0.258 . . . . 0.0 110.985 176.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.41 161.7 43.74 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.181 2.587 . . . . 0.0 112.619 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.535 ' HD3' ' N ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -68.6 -20.4 64.5 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.501 -175.083 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . 0.535 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 21.0 m -77.32 -2.51 35.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.328 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.688 ' HB2' ' HB2' ' A' ' 18' ' ' ASP . . . -74.22 143.49 45.11 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.338 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -86.04 173.01 10.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.993 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.23 -39.7 60.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -64.84 -41.16 95.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.338 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.688 ' HB2' ' HB2' ' A' ' 14' ' ' ALA . 3.3 m-20 -62.01 -44.12 97.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.248 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.622 HG21 ' HD2' ' A' ' 53' ' ' TYR . 1.9 mp -63.92 -38.67 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.456 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -36.08 80.82 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.798 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.715 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.1 mmpt? -64.07 -46.62 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.122 175.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -63.74 -37.51 87.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 110.591 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.695 ' HD1' HG23 ' A' ' 49' ' ' VAL . 2.7 t80 -63.02 -46.7 86.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.792 175.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -67.55 -37.2 82.33 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -176.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -67.89 -40.76 83.48 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.177 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.915 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.6 ttmm -70.23 -42.5 72.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.371 0.605 . . . . 0.0 109.56 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.55 -44.7 85.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.399 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.5 -46.25 90.79 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.391 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -63.09 -31.54 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.139 -177.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.693 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 89.1 m95 -106.09 18.89 21.37 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.077 0.465 . . . . 0.0 111.323 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m170 -83.65 143.75 44.46 Favored Pre-proline 0 C--N 1.32 -0.675 0 O-C-N 122.069 -0.395 . . . . 0.0 110.165 173.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.0 -25.92 56.29 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.671 2.914 . . . . 0.0 111.941 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -59.73 -33.63 71.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.21 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -113.68 -29.88 6.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.611 HD21 ' HB2' ' A' ' 42' ' ' ALA . 65.7 t30 -102.44 132.5 21.32 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.597 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 74.2 Cg_endo -73.61 -115.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.982 2.454 . . . . 0.0 115.699 -167.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.91 -7.2 58.85 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -165.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -101.62 98.41 8.71 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.38 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -103.92 -23.13 13.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.767 -176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.547 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 21.5 tt0 -66.26 -41.02 90.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.299 0.571 . . . . 0.0 110.601 -178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.34 -37.46 83.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.83 177.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -66.66 -44.39 81.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.029 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.547 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 12.9 pt-20 -67.34 -36.46 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.75 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -60.05 -40.85 90.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.715 0.293 . . . . 0.0 110.706 174.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 68.2 mmtt -71.84 -35.25 69.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.799 0.333 . . . . 0.0 110.565 177.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.44 -39.33 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.718 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -65.31 -41.72 93.77 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.431 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.28 -43.2 98.6 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.473 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.915 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 6.7 p -70.42 -38.84 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.524 178.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.43 -45.07 95.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.554 0.216 . . . . 0.0 111.58 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.447 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.0 pt-20 -71.91 -43.63 65.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.017 0.437 . . . . 0.0 111.032 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.63 67.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.43 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.622 ' HD2' HG21 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -70.63 -33.66 71.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -60.68 -42.31 96.84 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.535 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.752 HG11 ' HG3' ' A' ' 61' ' ' LYS . 64.3 t -69.04 -44.81 80.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.001 0.429 . . . . 0.0 110.566 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.543 ' HG ' HG12 ' A' ' 19' ' ' ILE . 40.3 tp -72.25 -17.48 61.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.323 -175.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.8 m -82.83 -18.39 40.61 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 122.043 -0.41 . . . . 0.0 111.922 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -109.01 123.4 49.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.202 0.525 . . . . 0.0 111.482 -175.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -61.08 -38.01 84.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.653 -177.734 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.414 ' O ' HD11 ' A' ' 64' ' ' ILE . 80.6 t60 -65.12 -40.51 94.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.752 ' HG3' HG11 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -70.28 -33.63 71.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.382 177.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.74 -47.46 83.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.097 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.404 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 9.4 pt-20 -71.32 -34.96 71.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.863 -177.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.414 HD11 ' O ' ' A' ' 60' ' ' HIS . 1.5 mp -65.04 -42.5 94.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -65.62 -36.73 84.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.978 0.418 . . . . 0.0 110.225 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.19 -47.84 78.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.661 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.669 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 10.8 ptm180 -88.58 -48.86 7.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -94.3 -10.56 32.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.92 0.391 . . . . 0.0 111.176 -168.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.4 -49.32 6.29 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.474 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -67.42 -25.52 65.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.673 -0.763 . . . . 0.0 112.751 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.669 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 75.4 mm-40 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.929 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.802 ' HA ' HG12 ' A' ' 7' ' ' ILE . 66.8 m-85 -68.44 -26.12 65.36 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.67 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.0 -39.31 81.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.667 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -73.51 -44.21 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.847 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.837 HD11 ' HB2' ' A' ' 52' ' ' ALA . 12.4 pt -71.81 -42.31 69.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -172.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.498 ' N ' HG13 ' A' ' 7' ' ' ILE . 15.6 mt -103.85 -75.3 0.62 Allowed 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 120.966 0.412 . . . . 0.0 109.937 176.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 168.95 -30.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.514 -174.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.0 m -120.66 154.12 56.98 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.9 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.76 -178.63 4.54 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.994 2.463 . . . . 0.0 112.616 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.85 -17.58 61.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.99 0.424 . . . . 0.0 111.346 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -23.42 66.7 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.562 175.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 145.84 44.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.914 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.2 m -67.63 159.78 29.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.978 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.04 -36.27 60.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.179 0.514 . . . . 0.0 111.223 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -61.5 -40.28 94.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.812 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -62.2 -44.61 96.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.657 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.85 -45.73 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.748 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.5 ttmm -60.83 -40.85 94.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.773 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 9.6 mmmm -70.33 -35.56 73.69 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.92 -41.58 96.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.268 0.556 . . . . 0.0 109.642 173.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.65 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -65.47 -44.11 88.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.012 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -61.88 -41.16 97.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.748 0.309 . . . . 0.0 111.629 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -67.48 -44.12 79.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.503 . . . . 0.0 110.952 175.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CG ' ' HB ' ' A' ' 49' ' ' VAL . 3.6 tppp? -60.35 -38.59 84.29 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.311 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.693 ' HA ' ' NE1' ' A' ' 30' ' ' TRP . . . -60.62 -42.13 96.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.995 175.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.4 -35.4 73.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.65 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 24.2 mm-40 -60.38 -33.37 72.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.275 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.693 ' NE1' ' HA ' ' A' ' 27' ' ' ALA . 64.1 p-90 -106.46 6.42 30.24 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.626 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.1 m170 -74.2 146.99 85.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.549 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 17.0 Cg_endo -55.67 -28.1 64.3 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.758 2.972 . . . . 0.0 112.687 -176.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.82 -24.38 63.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.124 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -119.16 -10.87 9.69 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -104.44 133.86 19.98 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 92.1 Cg_endo -96.56 -112.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.394 2.73 . . . . 0.0 113.096 -177.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -85.23 -6.75 59.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.61 0.719 . . . . 0.0 110.065 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.758 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.2 m120 -90.66 103.09 15.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.731 -174.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -98.2 -29.32 13.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.091 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.523 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 34.1 tt0 -59.71 -44.69 93.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.133 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.758 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 93.4 m-85 -65.04 -37.65 88.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.913 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.25 -44.7 94.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.188 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.04 -37.95 75.72 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.748 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 55.7 mtpt -63.75 -46.29 85.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.616 0.246 . . . . 0.0 110.99 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.619 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 30.1 mmtp -66.55 -34.68 78.44 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.32 -50.89 71.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.077 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HB2' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -69.08 -43.15 75.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.103 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.619 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 9.1 pt-20 -64.83 -37.31 87.19 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.971 -175.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.65 HG23 ' HD1' ' A' ' 23' ' ' TYR . 13.1 p -72.42 -38.94 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 C-N-CA 120.139 -0.625 . . . . 0.0 110.869 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.33 -45.41 91.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 11.1 pt-20 -72.02 -43.16 65.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.058 -179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.837 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -75.07 -42.48 56.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.177 -173.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.501 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 4.1 t80 -70.89 -35.57 72.39 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.215 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.96 -50.46 68.54 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.01 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.541 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.6 p -62.55 -41.3 91.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -175.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 tp -75.18 -28.96 60.24 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.1 m -85.9 -19.44 30.53 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.777 0.322 . . . . 0.0 111.043 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -102.51 124.22 47.68 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.593 0.711 . . . . 0.0 110.767 -177.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.659 ' N ' ' HD2' ' A' ' 59' ' ' LYS . 8.0 mptt -68.86 -31.43 70.37 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.154 -175.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.601 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 87.9 m-70 -70.44 -43.83 69.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.187 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.541 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -65.08 -34.42 78.38 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 175.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 mmm180 -59.25 -41.66 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.625 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.601 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 41.7 mt-10 -60.59 -43.37 97.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.827 0.346 . . . . 0.0 110.799 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.36 -44.93 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -66.18 -35.25 79.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.234 0.54 . . . . 0.0 110.413 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.89 -45.79 87.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.611 -177.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -88.46 -37.56 15.71 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -101.0 9.87 41.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 0.0 111.495 -171.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.77 -56.43 4.15 Favored Glycine 0 CA--C 1.508 -0.369 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.53 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -66.62 -36.63 83.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.154 -0.523 . . . . 0.0 112.064 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.793 -0.623 . . . . 0.0 111.012 -176.734 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.3 p . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.483 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 38.2 m-85 -68.82 -27.05 65.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.176 0.513 . . . . 0.0 110.971 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.592 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 1.3 p90 -66.78 -32.7 74.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.489 173.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -74.25 -43.83 55.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.124 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.483 ' CG1' ' HA ' ' A' ' 4' ' ' TYR . 2.5 pp -71.6 -33.21 48.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.781 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.425 HD22 HG23 ' A' ' 19' ' ' ILE . 54.0 tp -99.36 -79.69 0.48 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.966 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 176.35 -41.02 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.16 -175.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 m -122.99 151.55 61.52 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.197 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.592 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 27.4 Cg_endo -64.37 151.39 85.69 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.137 2.558 . . . . 0.0 112.166 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -73.38 -15.03 61.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.21 -172.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.9 m -62.2 -18.88 62.32 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.937 174.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -73.49 145.94 45.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.8 t -66.12 161.7 21.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.458 -177.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.5 50.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.202 0.525 . . . . 0.0 110.665 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -60.72 -41.89 96.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.411 178.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.435 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 10.5 m-20 -68.28 -41.24 81.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.497 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.607 HG21 ' HD1' ' A' ' 53' ' ' TYR . 1.7 mp -60.77 -42.85 93.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.932 174.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -62.0 -40.86 97.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.409 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.5 mmpt? -63.08 -40.97 99.24 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.4 176.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -60.45 -46.13 91.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.096 0.474 . . . . 0.0 110.258 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.491 ' HD1' HG23 ' A' ' 49' ' ' VAL . 4.1 t80 -61.94 -48.59 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.8 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.95 78.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' A' ' 25' ' ' ARG . 18.6 ttt-85 -60.58 -44.06 96.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.997 177.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.758 ' HD2' HG21 ' A' ' 49' ' ' VAL . 58.4 mttm -67.72 -37.19 81.9 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.267 0.556 . . . . 0.0 109.922 177.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.48 75.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.708 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 3.5 mm? -71.89 -35.78 69.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.01 0.433 . . . . 0.0 111.047 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.01 -38.78 89.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.847 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -109.61 20.69 17.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.348 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.479 ' HB2' ' HA ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -69.29 145.69 96.07 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.382 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 10.5 Cg_endo -53.52 -34.34 72.0 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 122.355 2.037 . . . . 0.0 113.098 -168.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.91 -24.17 63.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.072 0.463 . . . . 0.0 110.969 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -113.87 7.89 17.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.99 145.77 31.19 Favored Pre-proline 0 C--O 1.234 0.286 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.058 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -81.44 -120.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.941 2.428 . . . . 0.0 112.949 -174.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -97.11 -8.15 30.91 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.866 0.365 . . . . 0.0 111.218 -176.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -98.61 100.63 11.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.951 0.405 . . . . 0.0 110.26 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 13.8 mptt -92.61 -30.67 15.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.314 175.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 15.5 tp10 -60.84 -43.94 97.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.897 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -72.32 -38.29 68.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.586 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.32 90.83 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 11.2 pt-20 -71.22 -37.76 72.04 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.907 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 20.6 tptp -61.12 -45.96 92.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.549 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -65.96 -38.14 87.82 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.995 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -62.15 -40.08 94.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.653 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.4 mmtt -66.74 -41.77 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.856 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.32 -44.12 92.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.001 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.758 HG21 ' HD2' ' A' ' 26' ' ' LYS . 7.3 p -72.03 -38.28 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.007 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.08 95.6 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.213 -0.195 . . . . 0.0 111.37 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -72.05 -40.27 68.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.0 110.728 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.39 -38.96 68.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.633 -174.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.607 ' HD1' HG21 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.84 -40.48 72.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -62.12 -49.88 74.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.012 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.02 -38.08 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 111.306 -177.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.0 tp -72.99 -26.26 61.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.772 0.32 . . . . 0.0 111.418 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -82.06 -18.8 41.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.674 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.468 ' HB3' ' HB2' ' A' ' 61' ' ' LYS . 17.6 t70 -110.35 122.2 47.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 0.0 110.318 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.522 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -66.35 -34.33 77.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.427 -174.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.522 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 33.6 t60 -71.97 -40.51 68.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.468 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.13 -34.32 77.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.972 177.339 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' A' ' 66' ' ' ASP . 0.8 OUTLIER -60.15 -42.56 95.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.788 173.805 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 38.4 mt-10 -61.05 -44.71 96.98 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.176 0.512 . . . . 0.0 110.107 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 48.7 mm -68.82 -46.09 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.804 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -64.5 -35.91 82.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -177.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -70.32 -45.66 65.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.088 -174.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.578 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 9.1 ptm180 -85.61 -27.48 25.43 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.4 9.93 29.66 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.806 0.812 . . . . 0.0 109.792 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.82 -50.4 3.11 Favored Glycine 0 N--CA 1.442 -0.904 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.17 172.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -65.16 -46.92 78.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.755 -0.723 . . . . 0.0 111.812 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 9.5 pt-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.413 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.9 t . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.569 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 85.1 m-85 -62.54 -29.86 70.87 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.86 0.362 . . . . 0.0 111.52 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -34.78 78.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.914 0.388 . . . . 0.0 110.758 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -75.45 -43.87 47.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.899 176.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.614 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.7 pp -67.82 -38.37 80.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.882 0.372 . . . . 0.0 111.039 -177.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.1 tp -101.01 -93.97 0.28 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 175.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.484 ' OD1' HG11 ' A' ' 10' ' ' VAL . 4.5 p30 -178.72 -19.87 0.0 OUTLIER 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.58 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.484 HG11 ' OD1' ' A' ' 9' ' ' ASP . 16.2 m -118.74 150.9 49.24 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.984 0.421 . . . . 0.0 110.768 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -94.85 -178.12 0.53 Allowed 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 123.405 2.737 . . . . 0.0 112.982 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.3 ptt85 -64.66 -27.56 69.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.682 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.8 p -63.3 -20.49 65.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.448 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.521 ' HB2' HD13 ' A' ' 19' ' ' ILE . . . -80.33 146.98 31.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.54 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.6 t -50.56 141.68 12.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.137 175.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.64 -31.92 64.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.004 0.43 . . . . 0.0 110.699 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.478 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 7.3 m-20 -65.91 -34.61 78.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.766 174.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.42 -43.26 77.57 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.222 178.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.521 HD13 ' HB2' ' A' ' 14' ' ' ALA . 2.0 mp -60.26 -38.95 79.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.35 0.595 . . . . 0.0 109.862 173.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -65.32 -34.72 79.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.912 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.37 -43.23 95.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 173.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.79 93.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.105 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.667 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -62.09 -42.65 99.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.135 176.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -66.83 -43.6 83.31 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.523 -177.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -70.15 -32.2 70.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.127 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -61.17 -43.47 98.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.423 0.63 . . . . 0.0 109.973 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.79 71.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.96 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.37 -36.53 79.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.868 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -62.17 -39.57 93.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.885 0.374 . . . . 0.0 111.153 -178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -108.42 18.77 20.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.326 0.584 . . . . 0.0 110.614 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.507 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 14.2 t-80 -71.86 139.32 82.87 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.965 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.507 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 14.7 Cg_endo -55.97 -32.22 84.96 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 123.912 3.075 . . . . 0.0 114.424 -170.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.66 -28.92 65.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.794 0.33 . . . . 0.0 110.605 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.27 9.73 41.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -104.5 134.28 19.75 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.8 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.73 -110.17 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.824 2.35 . . . . 0.0 113.489 -177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -97.67 -11.59 23.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -107.89 101.29 10.58 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.874 -176.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -98.94 -18.98 17.56 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.17 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -59.42 -47.61 84.82 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.9 p90 -72.06 -36.54 69.61 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.238 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.9 94.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.367 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -68.9 -38.77 79.82 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.885 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -68.61 -36.55 78.82 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.04 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 66.8 mmtt -64.71 -33.34 75.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -68.92 -39.94 79.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.328 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -62.59 -47.8 82.2 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.108 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 7.1 pt-20 -65.87 -44.08 86.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.314 -176.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.667 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.7 p -65.58 -38.34 82.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.237 -0.585 . . . . 0.0 111.144 -177.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.85 82.19 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.903 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -74.0 -41.31 62.08 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.157 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -74.44 -35.95 63.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.922 -173.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.623 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -69.18 -42.72 75.47 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 176.638 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -57.95 -48.49 79.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.809 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.41 HG11 ' HA ' ' A' ' 52' ' ' ALA . 11.2 p -69.68 -41.64 80.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.598 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.68 HD23 ' HD3' ' A' ' 62' ' ' ARG . 2.9 tm? -73.91 -30.27 62.49 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.1 t -78.96 -17.57 55.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.153 -0.342 . . . . 0.0 110.861 -176.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.48 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 22.0 t70 -112.44 127.53 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.321 0.581 . . . . 0.0 110.504 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.41 -36.36 82.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.293 -175.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.51 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 73.6 t60 -68.37 -40.56 81.41 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.48 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 74.9 mmtt -61.17 -43.18 99.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.549 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.68 ' HD3' HD23 ' A' ' 56' ' ' LEU . 50.6 mtm105 -60.45 -45.08 94.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 178.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -60.9 -39.91 91.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.622 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 60' ' ' HIS . 33.8 mm -65.2 -44.26 95.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.078 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -61.59 -38.49 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.061 0.458 . . . . 0.0 110.516 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -64.99 -46.36 81.79 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.421 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.405 ' HD3' HD12 ' A' ' 64' ' ' ILE . 11.7 ptm180 -81.4 -28.44 34.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -176.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -93.49 -8.61 41.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.86 0.362 . . . . 0.0 110.799 -174.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -52.42 -50.53 47.24 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.703 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.07 -28.24 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.181 -0.509 . . . . 0.0 112.111 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.056 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.1 m . . . . . 0 C--O 1.226 -0.139 0 CA-C-O 121.343 0.592 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.812 ' HA ' HG12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -69.17 -38.01 78.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.293 -172.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.603 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.6 p90 -61.28 -33.27 73.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.147 173.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -75.37 -44.21 46.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.626 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.812 HG12 ' HA ' ' A' ' 4' ' ' TYR . 11.0 pt -70.5 -40.33 77.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -169.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.493 HD12 HG23 ' A' ' 19' ' ' ILE . 18.5 mt -93.34 -75.61 0.49 Allowed 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.319 -176.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.0 t70 171.58 -24.48 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 O-C-N 124.338 1.024 . . . . 0.0 110.779 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 31.4 m -118.61 150.88 49.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.593 -170.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -91.36 -179.78 1.44 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.534 2.823 . . . . 0.0 113.067 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.644 ' HA ' ' HE2' ' A' ' 4' ' ' TYR . 32.9 mtm180 -60.14 -15.16 21.4 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.459 -167.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -82.18 -6.82 59.48 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.06 135.39 35.82 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.103 0.478 . . . . 0.0 111.044 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 t -81.05 166.11 21.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.619 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.31 -43.75 64.68 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -172.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 1.3 m-20 -65.74 -33.45 75.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.534 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -67.68 -40.49 84.41 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.715 HD13 ' HH ' ' A' ' 4' ' ' TYR . 1.8 mp -60.68 -41.52 88.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.056 173.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 36.4 ttmt -55.74 -43.71 76.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.18 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -69.37 -35.66 76.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.225 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.489 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -60.45 -42.51 96.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.082 0.468 . . . . 0.0 110.472 177.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.911 ' HD1' HG23 ' A' ' 49' ' ' VAL . 3.4 t80 -63.22 -43.23 98.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.864 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.438 ' O ' HD12 ' A' ' 28' ' ' LEU . 70.9 mtp180 -68.31 -44.17 76.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.489 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 10.1 ptm180 -66.1 -33.52 75.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.04 0.448 . . . . 0.0 110.492 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.6 ' HD3' ' HB ' ' A' ' 49' ' ' VAL . 35.7 tttp -70.42 -43.59 69.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.556 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.48 -47.74 81.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.566 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 24' ' ' ARG . 7.4 mp -62.88 -37.59 87.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.336 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.73 -30.17 71.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.975 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.574 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 59.1 m95 -108.46 17.56 21.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 111.479 -178.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -83.19 152.32 64.7 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 171.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -54.9 -27.04 51.63 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.845 3.03 . . . . 0.0 112.862 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.51 -34.79 77.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.36 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.14 -31.88 8.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.022 0.439 . . . . 0.0 111.554 -177.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -103.9 135.0 19.42 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.12 -119.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.82 2.347 . . . . 0.0 114.589 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -94.29 -7.65 41.3 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -167.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -93.55 101.64 13.82 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -94.52 -26.88 16.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -173.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.13 -46.51 88.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.273 -175.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.46 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 18.9 m-85 -72.96 -38.5 66.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -62.47 -46.15 89.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 3.1 pt-20 -70.29 -36.04 74.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.354 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.612 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 12.1 mmmt -58.83 -44.64 90.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.875 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 30.6 mmtp -66.84 -35.35 79.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.075 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -64.16 -40.25 95.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.296 174.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -67.01 -36.52 82.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.99 176.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 43.4 mm-40 -63.29 -44.69 94.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.014 0.435 . . . . 0.0 110.417 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.911 HG23 ' HD1' ' A' ' 23' ' ' TYR . 3.2 p -72.73 -37.38 55.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.92 177.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.62 -44.94 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.475 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.16 -42.85 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.05 0.453 . . . . 0.0 111.244 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.525 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -71.47 -34.84 70.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.392 0.615 . . . . 0.0 111.552 -176.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.425 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 28.0 t80 -71.58 -34.7 70.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.932 175.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.03 -49.99 75.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.119 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.802 HG22 ' HG3' ' A' ' 61' ' ' LYS . 7.1 p -65.18 -38.52 82.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.338 . . . . 0.0 110.737 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.54 HD11 ' O ' ' A' ' 56' ' ' LEU . 0.8 OUTLIER -73.73 -18.49 60.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.983 0.421 . . . . 0.0 110.96 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 t -78.27 -22.81 47.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.01 -174.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -112.15 124.56 52.7 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.15 -35.84 81.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.297 0.57 . . . . 0.0 110.98 -172.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.602 ' O ' HG12 ' A' ' 64' ' ' ILE . 48.9 t60 -70.6 -41.4 72.36 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.126 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.802 ' HG3' HG22 ' A' ' 55' ' ' VAL . 3.7 tppp? -61.87 -36.35 81.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.523 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.4 ' HG2' HD23 ' A' ' 56' ' ' LEU . 23.0 mtp180 -58.86 -46.55 87.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.516 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.1 pt-20 -71.71 -33.96 69.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.693 0.282 . . . . 0.0 110.343 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 60' ' ' HIS . 48.9 mm -64.51 -44.68 96.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 CA-C-O 121.129 0.49 . . . . 0.0 109.704 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -58.63 -41.99 87.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.874 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -72.85 -45.91 55.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.797 -175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 -86.72 -29.31 22.5 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -94.68 -7.23 41.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.126 0.489 . . . . 0.0 110.201 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 -37.45 94.55 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -60.7 -26.41 67.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.923 -1.138 . . . . 0.0 111.701 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.764 179.462 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.411 ' HA ' ' CZ ' ' A' ' 5' ' ' TYR . 3.1 m . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.613 ' O ' HG13 ' A' ' 7' ' ' ILE . 60.2 m-85 -68.31 -24.58 64.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.694 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.573 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 4.3 p90 -57.63 -32.73 67.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.766 173.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.508 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 9.1 mm-40 -73.59 -44.32 57.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.021 0.438 . . . . 0.0 110.929 178.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.3 pp -71.11 -31.02 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.751 -174.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.412 HD22 HG23 ' A' ' 19' ' ' ILE . 61.1 tp -97.66 -79.94 0.46 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.601 -179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.611 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 25.1 t70 174.73 -40.56 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 30.1 m -121.72 157.49 56.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.527 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.573 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 5.9 Cg_exo -78.34 159.82 29.35 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.388 2.725 . . . . 0.0 112.486 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -62.44 -22.55 66.29 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.646 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -65.71 -17.97 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.277 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.98 146.46 43.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.819 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.8 t -59.61 156.67 13.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.07 -42.35 63.11 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -174.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -62.89 -34.57 77.68 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.71 -44.13 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.621 0.248 . . . . 0.0 111.112 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.412 HG23 HD22 ' A' ' 8' ' ' LEU . 2.0 mp -60.2 -44.61 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.338 0.589 . . . . 0.0 109.979 175.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -65.43 -36.98 85.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.471 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.821 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.076 176.761 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.611 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.54 -44.21 96.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.892 0.377 . . . . 0.0 110.756 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.734 ' HD1' HG23 ' A' ' 49' ' ' VAL . 1.1 t80 -57.98 -49.39 76.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.686 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 25.9 mtp180 -68.0 -32.68 73.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.706 0.288 . . . . 0.0 111.176 -178.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 22.3 ttm180 -63.75 -46.62 84.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.304 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -70.96 -40.85 71.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.067 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.27 -37.2 66.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.422 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -70.5 -36.86 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.473 178.606 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 13.1 mm-40 -63.31 -35.63 81.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.079 0.466 . . . . 0.0 110.616 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m95 -105.75 19.0 21.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.651 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.521 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.2 t-80 -72.3 141.41 83.34 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.521 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 13.4 Cg_endo -55.2 -31.06 74.37 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.844 3.029 . . . . 0.0 114.205 -168.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -70.61 -34.48 72.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.025 0.44 . . . . 0.0 111.183 177.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -90.26 -0.74 57.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.326 0.584 . . . . 0.0 110.08 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.459 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 26.8 t-20 -103.2 141.83 23.3 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.54 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.89 -120.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.427 2.085 . . . . 0.0 112.695 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -100.15 -8.23 23.9 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -104.9 100.94 10.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.972 0.415 . . . . 0.0 110.467 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -96.88 -17.87 19.88 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.268 -177.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.434 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 6.6 tp10 -53.4 -46.93 69.91 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.451 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -73.47 -36.73 65.89 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.459 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.17 -45.78 91.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.742 0.306 . . . . 0.0 111.231 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 9.4 pt-20 -69.59 -37.64 77.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.496 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.631 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -60.56 -45.77 92.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.162 178.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -66.03 -39.28 90.06 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.281 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -59.04 -40.33 84.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.213 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.13 -40.97 82.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.716 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 13.4 mm-40 -63.64 -44.59 93.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.999 -176.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.734 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.3 p -72.26 -37.76 59.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.791 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.94 92.59 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.41 -38.85 68.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.981 0.42 . . . . 0.0 110.871 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.38 -36.95 71.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.666 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.77 -36.98 67.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.08 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.23 -47.49 85.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.553 HG21 ' HB3' ' A' ' 61' ' ' LYS . 9.0 p -69.78 -38.12 75.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.091 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.466 HD22 ' O ' ' A' ' 56' ' ' LEU . 8.2 tt -71.59 -29.34 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -173.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -78.86 -19.38 52.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.669 0.271 . . . . 0.0 111.514 -174.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.474 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 21.7 t70 -113.13 133.38 55.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.292 0.568 . . . . 0.0 111.415 -176.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.479 ' HE3' ' HB2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.96 -34.47 78.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.853 -177.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.425 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.3 m80 -68.96 -44.43 72.97 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.176 0.512 . . . . 0.0 110.124 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.553 ' HB3' HG21 ' A' ' 55' ' ' VAL . 14.1 mmmm -65.01 -37.94 89.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.566 -176.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 27.7 mtm180 -66.16 -45.58 80.44 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 -177.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 9.7 pt-20 -71.76 -32.71 67.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.893 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.589 HD12 ' HD3' ' A' ' 67' ' ' ARG . 30.1 mm -66.84 -36.01 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -63.18 -36.2 82.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.44 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -45.7 79.93 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.582 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.589 ' HD3' HD12 ' A' ' 64' ' ' ILE . 10.2 ptm180 -83.93 -47.13 11.35 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -94.65 -9.61 34.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.91 0.386 . . . . 0.0 111.239 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.59 -53.06 4.48 Favored Glycine 0 CA--C 1.507 -0.425 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.982 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 mmm-85 -61.18 -27.04 68.13 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.05 -0.575 . . . . 0.0 112.197 -177.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.614 -0.708 . . . . 0.0 110.609 -179.02 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' SER . . . . . 0.461 ' O ' HG22 ' A' ' 7' ' ' ILE . 15.8 m . . . . . 0 C--O 1.226 -0.159 0 CA-C-O 121.083 0.468 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.693 ' OH ' HG12 ' A' ' 19' ' ' ILE . 1.0 OUTLIER -63.59 -37.37 87.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.087 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -67.5 -31.92 72.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.389 . . . . 0.0 110.677 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -73.23 -44.35 59.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.392 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.571 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.5 pp -70.43 -39.12 76.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.315 -175.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.498 HD23 ' HB1' ' A' ' 22' ' ' ALA . 38.0 tp -101.47 -82.27 0.47 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.12 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.9 t70 174.08 -29.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.029 -175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -119.56 155.44 54.35 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.098 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.19 -177.63 3.97 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.032 2.488 . . . . 0.0 112.656 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.7 mtp180 -78.64 -9.37 59.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.846 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -74.3 -9.0 58.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.558 ' HB2' ' HB3' ' A' ' 18' ' ' ASP . . . -84.55 144.22 28.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.638 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.4 m -80.8 167.67 19.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.749 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.91 -43.11 65.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.679 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.42 -35.86 78.73 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.166 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.558 ' HB3' ' HB2' ' A' ' 14' ' ' ALA . 41.1 t0 -70.22 -43.76 69.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.306 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.693 HG12 ' OH ' ' A' ' 4' ' ' TYR . 1.2 mp -61.12 -41.76 90.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.743 175.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.832 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 58.0 mttm -55.6 -45.9 77.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.001 173.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -35.01 79.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.502 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.658 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -66.36 -43.9 84.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.832 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 3.4 p90 -66.43 -37.15 84.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.966 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 24' ' ' ARG . 26.5 mtp180 -57.2 -44.81 83.99 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 123.153 0.283 . . . . 0.0 111.164 177.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.658 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 7.2 ptm180 -67.3 -34.43 77.37 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.103 0.478 . . . . 0.0 110.427 -177.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -67.54 -38.42 84.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.121 175.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HA ' ' CE2' ' A' ' 30' ' ' TRP . . . -55.49 -40.64 71.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.306 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 28' ' ' LEU . 1.7 mm? -66.6 -35.9 81.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.055 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -62.39 -34.78 77.39 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.518 ' CE2' ' HA ' ' A' ' 27' ' ' ALA . 47.4 p-90 -105.14 12.27 32.22 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 110.745 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.611 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 16.4 t-80 -72.19 142.21 84.53 Favored Pre-proline 0 C--N 1.321 -0.662 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 15.0 Cg_endo -54.44 -27.95 51.9 Favored 'Trans proline' 0 N--CA 1.482 0.797 0 C-N-CA 124.111 3.207 . . . . 0.0 114.616 -168.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -70.65 -29.84 66.29 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.902 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -91.69 -46.15 8.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.883 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 67.2 t30 -103.42 129.12 26.05 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 41.6 Cg_endo -91.1 -101.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.577 2.185 . . . . 0.0 115.103 -167.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -86.32 -8.56 57.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.821 0.343 . . . . 0.0 111.84 -168.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -94.85 99.9 11.88 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.828 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 0.9 OUTLIER -93.91 -18.38 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.964 178.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 8.5 tp10 -54.95 -46.12 74.96 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.121 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -72.14 -40.77 67.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.76 177.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.465 ' HA ' ' HB2' ' A' ' 30' ' ' TRP . . . -62.38 -45.97 90.73 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.225 -174.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.0 pt-20 -71.71 -37.22 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.995 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.55 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -65.96 -40.29 91.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.671 -177.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.489 ' O ' HG13 ' A' ' 49' ' ' VAL . 67.1 mmtt -69.28 -35.31 75.91 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.258 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -59.24 -42.65 91.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.949 173.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -66.77 -42.84 85.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.763 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.28 -44.45 95.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.244 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.557 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 8.3 p -72.59 -37.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.304 -178.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -61.4 -45.94 92.24 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.14 -176.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.406 ' O ' HG13 ' A' ' 55' ' ' VAL . 13.2 pt-20 -72.15 -43.23 64.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.021 0.439 . . . . 0.0 110.897 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.571 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -72.5 -38.95 68.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.86 -173.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.557 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -70.99 -42.6 69.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . 0.523 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.8 OUTLIER -58.64 -49.73 76.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.483 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.642 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.3 p -70.06 -45.17 77.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-N 116.343 -0.389 . . . . 0.0 112.003 -178.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.753 HD21 ' HD3' ' A' ' 62' ' ' ARG . 12.4 mt -74.87 -29.69 61.09 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.5 t -80.09 -18.36 50.17 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.682 -177.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -111.91 127.45 55.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.634 ' N ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -69.19 -28.85 66.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.235 -173.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -68.63 -43.17 76.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.46 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.642 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.8 OUTLIER -70.25 -38.26 75.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.481 -178.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.753 ' HD3' HD21 ' A' ' 56' ' ' LEU . 12.2 mmm180 -58.15 -38.19 76.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.968 175.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.446 ' O ' ' HD2' ' A' ' 67' ' ' ARG . 6.1 mm-40 -66.19 -42.91 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.383 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 41.5 mm -64.01 -44.29 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.773 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . 0.401 ' HB2' HG23 ' A' ' 55' ' ' VAL . 52.0 t80 -67.08 -37.37 83.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.881 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -73.17 -46.3 51.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.024 0.44 . . . . 0.0 111.443 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 63' ' ' GLU . 4.1 ptm85 -81.28 -44.09 18.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.619 -173.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -94.89 -10.46 31.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -70.07 -49.56 33.41 Favored Glycine 0 CA--C 1.505 -0.57 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.649 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -65.2 -25.37 67.68 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.958 -0.621 . . . . 0.0 111.943 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 28.1 mm-40 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.042 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.569 ' O ' HG13 ' A' ' 7' ' ' ILE . 45.9 m-85 -68.37 -28.88 67.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.948 0.404 . . . . 0.0 111.114 -176.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -64.22 -32.46 74.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.006 0.432 . . . . 0.0 110.771 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.03 -43.84 51.32 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.313 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.4 pp -70.36 -37.83 72.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.34 -174.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -100.72 -84.62 0.43 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.8 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.853 ' HB3' ' HB3' ' A' ' 22' ' ' ALA . 31.8 t70 176.35 -33.24 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.41 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.3 m -119.99 156.77 54.16 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.145 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 86.6 Cg_endo -78.54 -177.49 3.93 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.92 2.413 . . . . 0.0 112.888 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -77.53 -21.78 52.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.041 0.448 . . . . 0.0 111.126 -178.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -78.76 1.79 21.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.582 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.442 ' HB2' HD13 ' A' ' 19' ' ' ILE . . . -84.57 145.79 27.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 0.0 110.737 177.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.1 t -70.51 160.84 31.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.79 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.43 -42.7 64.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 0.0 111.667 -174.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -61.62 -35.66 78.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.545 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -63.27 -45.77 89.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.442 HD13 ' HB2' ' A' ' 14' ' ' ALA . 2.0 mp -62.38 -45.63 98.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.339 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.71 -39.91 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.773 0.32 . . . . 0.0 111.0 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.91 -42.15 81.58 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 177.289 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.853 ' HB3' ' HB3' ' A' ' 9' ' ' ASP . . . -60.78 -43.48 98.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.958 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.74 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -62.16 -47.87 82.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.777 178.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.538 ' HG3' ' CE2' ' A' ' 23' ' ' TYR . 88.8 mtt180 -69.29 -39.32 78.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.405 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 5.0 ptp180 -63.0 -38.17 90.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.632 178.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.465 ' HG3' ' HZ3' ' A' ' 30' ' ' TRP . 65.6 tttm -69.41 -40.75 77.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.221 0.534 . . . . 0.0 110.042 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.57 94.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.597 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.4 mp -71.56 -37.2 71.11 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -67.84 -28.59 67.69 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.618 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 12.5 m-90 -109.01 18.62 20.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.551 0.691 . . . . 0.0 110.698 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.504 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 54.6 t60 -74.06 142.87 79.84 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 172.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.76 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 11.3 Cg_endo -54.29 -28.92 55.07 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.504 2.802 . . . . 0.0 113.343 -173.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.45 -23.76 63.71 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.251 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -122.51 18.23 10.47 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.76 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -102.27 145.83 31.22 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.536 -175.701 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -81.79 -110.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 122.997 2.464 . . . . 0.0 113.421 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -93.48 -11.68 31.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.774 0.321 . . . . 0.0 111.524 -174.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.467 ' HB2' ' HB2' ' A' ' 41' ' ' PHE . 7.3 p30 -106.92 114.71 28.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.95 0.405 . . . . 0.0 111.036 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 5.5 mptt -103.86 -32.3 9.36 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.576 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -66.93 -43.99 81.81 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.496 177.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.467 ' HB2' ' HB2' ' A' ' 38' ' ' ASN . 75.0 m-85 -72.33 -37.39 68.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.095 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.618 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -61.46 -45.41 94.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.795 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -67.65 -35.77 79.51 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.146 176.742 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.595 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -61.93 -40.87 97.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.467 177.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -63.87 -34.6 78.31 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.193 0.52 . . . . 0.0 109.666 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . 0.401 ' O ' HG12 ' A' ' 49' ' ' VAL . 85.6 t80 -66.77 -41.8 87.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.042 175.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -57.68 -44.9 86.12 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 44' ' ' LYS . 50.8 mt-10 -63.01 -45.6 91.59 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.054 0.454 . . . . 0.0 110.277 -177.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.74 HG23 ' HD1' ' A' ' 23' ' ' TYR . 9.7 p -70.88 -37.18 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.126 -172.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.9 -45.56 88.78 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.041 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -72.66 -41.81 65.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.066 0.46 . . . . 0.0 110.747 -179.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.556 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -73.14 -43.66 61.25 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.996 -174.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.48 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -66.97 -35.38 79.84 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.837 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -60.73 -50.78 72.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.607 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.794 ' HA ' ' HD2' ' A' ' 61' ' ' LYS . 10.0 p -71.35 -39.55 72.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.582 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.428 ' O ' HD21 ' A' ' 56' ' ' LEU . 9.4 tt -72.83 -28.9 62.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -173.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -78.0 -15.33 59.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.409 -175.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.543 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 30.5 t70 -112.15 121.46 45.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.429 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -61.67 -34.33 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.549 -175.351 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -69.76 -44.5 70.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.776 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.794 ' HD2' ' HA ' ' A' ' 55' ' ' VAL . 22.8 ttmm -71.01 -43.37 68.1 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.915 -174.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 27.1 ptt180 -67.57 -38.57 84.3 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.511 -177.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 8.9 pt-20 -72.68 -36.39 67.88 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.498 177.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.91 -39.36 85.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.61 -35.32 80.63 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.007 0.432 . . . . 0.0 110.33 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -72.8 -48.9 34.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.896 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.23 -42.13 11.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -95.04 -10.67 30.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 0.0 110.359 -170.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.14 -46.58 93.69 Favored Glycine 0 CA--C 1.505 -0.54 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.695 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -61.9 -26.67 68.31 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.451 -0.874 . . . . 0.0 111.903 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.419 -177.566 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 CA--C 1.53 0.202 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.749 ' HA ' HG12 ' A' ' 7' ' ' ILE . 34.1 m-85 -63.09 -28.06 69.82 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.296 0.57 . . . . 0.0 109.823 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -61.26 -37.62 83.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.205 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -74.0 -42.6 60.13 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.132 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.835 HD11 ' HB2' ' A' ' 52' ' ' ALA . 11.2 pt -70.98 -41.99 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.697 -172.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.542 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 15.6 mt -102.83 -74.82 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.015 0.436 . . . . 0.0 110.312 178.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.4 t70 172.07 -31.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.804 -173.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.1 m -120.98 150.62 53.59 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.831 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -87.5 -172.2 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.247 2.632 . . . . 0.0 112.968 -176.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.489 ' HB3' ' CD2' ' A' ' 4' ' ' TYR . 15.7 ptm180 -68.31 -21.29 64.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.717 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p -67.94 -15.96 63.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.979 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.05 144.21 29.23 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.084 176.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 p -72.97 148.17 44.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.136 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.2 -31.08 41.14 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -167.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 2.9 m-20 -65.71 -35.27 80.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.37 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.39 -37.33 82.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.487 0.66 . . . . 0.0 109.433 176.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 8' ' ' LEU . 1.7 mp -60.31 -46.78 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.2 175.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 17' ' ' ASP . 21.1 pttm -66.01 -33.86 76.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.004 0.431 . . . . 0.0 110.359 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 7.8 tptm -66.71 -41.63 87.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.377 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.589 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -61.68 -40.16 93.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.476 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.483 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -57.42 -42.18 81.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.762 175.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -64.92 -38.18 90.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.991 0.424 . . . . 0.0 110.899 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -67.3 -44.38 79.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 22' ' ' ALA . 26.1 mtpp -62.83 -38.86 92.43 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.065 0.459 . . . . 0.0 109.804 176.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.17 -46.16 75.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.881 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.6 -36.93 73.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.038 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -62.07 -39.82 93.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.535 -176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.491 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 96.6 m95 -109.02 18.03 21.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.87 0.367 . . . . 0.0 111.87 -176.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.61 145.66 71.72 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 170.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 14.8 Cg_endo -55.27 -28.42 62.13 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.02 3.147 . . . . 0.0 113.695 -170.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.48 -29.26 69.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.958 0.408 . . . . 0.0 111.023 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -108.44 14.83 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.087 0.47 . . . . 0.0 110.329 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 28.6 t-20 -115.33 134.46 22.58 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -89.04 -107.81 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.838 2.359 . . . . 0.0 113.61 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.73 -10.22 23.45 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . 0.482 ' HB3' ' HD1' ' A' ' 41' ' ' PHE . 10.0 m120 -106.39 100.6 10.12 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.058 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -91.44 -28.66 17.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.315 -0.402 . . . . 0.0 109.993 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -56.4 -43.94 79.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.565 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.482 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 83.8 m-85 -66.99 -37.86 84.99 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.691 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -66.46 -44.95 81.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.347 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -69.36 -37.96 77.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.594 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.731 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 9.2 mtpm? -65.28 -46.1 81.81 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.719 176.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -64.61 -34.51 78.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.472 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.74 -40.86 98.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.661 174.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HE3' ' OE2' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -70.1 -33.94 72.49 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.435 176.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.731 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 17.3 mm-40 -63.8 -45.54 89.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 110.616 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.483 HG23 ' HD1' ' A' ' 23' ' ' TYR . 6.5 p -71.08 -36.13 61.78 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.181 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.67 -46.57 81.05 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.181 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 11.5 pt-20 -73.3 -43.54 60.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.109 0.481 . . . . 0.0 110.807 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.835 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -70.3 -38.92 75.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.718 -173.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -72.37 -37.82 68.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.308 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.16 -50.35 73.54 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.18 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.9 p -65.81 -42.74 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.404 HD21 HD12 ' A' ' 8' ' ' LEU . 40.0 tp -74.35 -29.24 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.6 t -79.74 -14.73 58.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.82 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.639 ' HB3' ' HD3' ' A' ' 61' ' ' LYS . 38.5 m-20 -109.68 121.37 45.06 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.42 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -66.03 -34.98 79.32 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.825 -173.154 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.545 ' HA ' ' OE2' ' A' ' 63' ' ' GLU . 64.8 t60 -71.93 -38.13 69.9 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.337 177.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.639 ' HD3' ' HB3' ' A' ' 58' ' ' ASP . 1.8 mptm? -68.69 -45.06 72.65 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.777 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -33.91 75.49 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.457 -178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.545 ' OE2' ' HA ' ' A' ' 60' ' ' HIS . 15.8 pt-20 -69.65 -37.0 76.59 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.552 -0.459 . . . . 0.0 109.835 177.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 24.0 mm -66.31 -44.09 91.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.062 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.61 -34.43 76.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.804 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.19 -47.13 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.6 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -89.4 -34.37 16.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -105.08 -4.1 22.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.221 0.534 . . . . 0.0 110.909 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.64 63.69 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.315 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -59.97 -37.57 79.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.005 -0.598 . . . . 0.0 111.848 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.627 -0.702 . . . . 0.0 111.088 -176.349 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 C--O 1.232 0.147 0 CA-C-O 121.17 0.509 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.662 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.9 m-85 -66.42 -27.97 68.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.468 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -63.99 -37.17 86.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.391 0.615 . . . . 0.0 109.553 175.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -73.14 -44.17 60.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.207 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.906 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.7 pp -71.75 -37.8 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 34.9 tp -99.89 -87.81 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.504 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 8' ' ' LEU . 5.7 p-10 170.65 -11.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.212 0.605 . . . . 0.0 110.376 177.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 19' ' ' ILE . 19.8 m -119.95 151.67 52.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.502 174.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -90.31 -168.18 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.217 2.611 . . . . 0.0 113.639 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -78.53 -31.48 47.57 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 m -70.58 -7.29 42.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.995 0.426 . . . . 0.0 111.29 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.502 ' HB3' HD13 ' A' ' 19' ' ' ILE . . . -76.3 144.06 40.47 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.036 176.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.7 t -74.94 154.93 37.93 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.229 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.24 -41.12 62.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.92 0.391 . . . . 0.0 111.434 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.42 -34.41 77.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.578 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -68.85 -41.13 78.86 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.502 HD13 ' HB3' ' A' ' 14' ' ' ALA . 2.0 mp -60.66 -41.88 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.314 0.578 . . . . 0.0 109.692 172.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -59.15 -42.66 91.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.011 177.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -42.77 86.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.607 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.33 -41.47 93.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.567 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . 0.764 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -64.22 -42.02 96.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.921 175.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -65.03 -43.53 92.09 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 25.3 ptt180 -69.86 -39.21 76.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -64.54 -39.82 94.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.24 -39.26 92.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.122 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -40.29 90.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.066 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 26.9 mm-40 -62.85 -37.32 86.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.261 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . 0.409 ' CE3' ' HB3' ' A' ' 45' ' ' LYS . 13.2 m0 -110.18 19.42 18.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.086 0.47 . . . . 0.0 111.269 -176.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.71 141.2 82.07 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.58 -29.11 68.47 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.382 2.722 . . . . 0.0 112.362 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.22 -33.31 75.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.77 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -115.83 18.9 15.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.734 -173.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.456 ' OD1' ' HD2' ' A' ' 39' ' ' LYS . 26.8 t-20 -115.51 135.16 22.57 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.851 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 58.8 Cg_endo -88.12 -106.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.924 2.416 . . . . 0.0 114.05 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -97.06 -8.41 30.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -171.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -103.25 99.41 9.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.456 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 12.4 mmmm -101.99 -30.0 11.46 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.227 -171.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -61.33 -45.53 94.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.002 -174.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -72.04 -36.4 69.62 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.168 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.58 -44.3 96.66 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.727 0.298 . . . . 0.0 111.007 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.55 -42.3 74.77 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.081 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -70.16 -37.71 75.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.324 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.46 ' O ' HG13 ' A' ' 49' ' ' VAL . 64.4 mmtt -68.26 -35.18 77.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.657 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -62.84 -39.71 95.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.694 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -65.53 -44.01 88.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.388 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -66.34 -42.62 87.86 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.77 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.764 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.0 p -66.11 -37.29 79.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.876 178.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . 0.496 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -62.19 -45.44 93.37 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 111.599 -178.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.56 -37.65 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.071 0.462 . . . . 0.0 110.41 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.906 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -75.4 -39.29 59.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.085 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.496 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -72.12 -35.34 69.11 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 179.01 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -61.63 -48.11 82.34 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.577 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.615 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 14.3 p -65.63 -38.8 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.955 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.408 HD22 ' HB3' ' A' ' 4' ' ' TYR . 52.5 tp -72.67 -28.19 62.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 t -78.57 -20.09 51.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.989 0.423 . . . . 0.0 110.328 -176.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.72 ' HB2' ' HB2' ' A' ' 61' ' ' LYS . 73.1 m-20 -111.77 121.85 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.595 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.501 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 3.4 mppt? -67.2 -34.29 77.19 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.48 ' O ' HG12 ' A' ' 64' ' ' ILE . 81.9 m-70 -69.73 -32.86 71.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.076 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.72 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.2 tppp? -71.41 -41.68 69.28 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' A' ' 55' ' ' VAL . 25.7 mtp180 -61.98 -42.6 99.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.576 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 13.1 pt-20 -67.55 -33.12 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.202 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.6 mm -65.2 -44.11 95.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 175.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -59.15 -37.48 77.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.259 0.552 . . . . 0.0 109.876 175.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -72.27 -47.25 51.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.144 -176.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -88.49 -37.51 15.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 71' ' ' GLU . 32.3 t80 -95.44 -9.49 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.877 0.37 . . . . 0.0 110.543 -173.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.69 -48.01 84.69 Favored Glycine 0 CA--C 1.51 -0.271 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.635 175.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.41 -25.98 68.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.473 -0.864 . . . . 0.0 111.465 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 68' ' ' TYR . 18.4 mm-40 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.07 -176.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.7 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' TYR . . . . . 0.567 ' CD1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -62.69 -38.08 88.97 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 122.002 -0.436 . . . . 0.0 111.32 -176.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' TYR . . . . . 0.434 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 3.6 p90 -61.3 -32.14 71.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.034 174.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -73.71 -45.09 54.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.916 0.388 . . . . 0.0 111.077 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ILE . . . . . 0.727 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.6 pp -71.72 -30.99 40.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.813 -176.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.0 tp -99.66 -87.03 0.37 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.424 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.729 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 23.9 t70 177.85 -33.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.038 0.447 . . . . 0.0 110.853 -174.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.02 156.52 56.77 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.417 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 80.3 Cg_endo -92.99 174.48 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.487 2.791 . . . . 0.0 112.844 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.746 ' HD3' ' H ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -57.34 -22.67 43.9 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 114.711 -1.132 . . . . 0.0 113.842 -168.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 t -58.64 -24.12 60.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.925 0.393 . . . . 0.0 111.113 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.847 ' HB3' ' HB3' ' A' ' 18' ' ' ASP . . . -78.82 143.78 35.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.144 0.497 . . . . 0.0 111.719 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.7 t -78.54 164.66 24.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.658 173.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.14 -34.44 44.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.168 0.509 . . . . 0.0 111.451 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.99 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.813 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ASP . . . . . 0.847 ' HB3' ' HB3' ' A' ' 14' ' ' ALA . 11.3 t70 -69.34 -36.61 77.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.808 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.534 HD13 ' HH ' ' A' ' 4' ' ' TYR . 1.5 mp -59.12 -43.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.995 172.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -65.13 -37.86 88.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.043 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.594 ' HA ' ' HE ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -70.24 -35.28 73.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.357 175.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.729 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -59.82 -42.09 92.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.26 0.552 . . . . 0.0 110.736 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.66 -40.85 96.13 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.408 173.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.594 ' HE ' ' HA ' ' A' ' 21' ' ' LYS . 9.9 mtm180 -67.19 -45.57 76.51 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.897 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . 0.437 ' O ' ' HG3' ' A' ' 29' ' ' GLN . 1.6 ptm180 -64.81 -32.63 74.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.865 0.364 . . . . 0.0 110.336 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LYS . . . . . 0.506 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 0.6 OUTLIER -71.31 -38.89 71.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.126 0.489 . . . . 0.0 110.139 176.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.19 -37.09 66.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.74 171.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.86 -35.72 79.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.423 175.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.506 ' OE1' ' HA ' ' A' ' 26' ' ' LYS . 50.9 mt-30 -62.24 -34.23 76.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.056 0.455 . . . . 0.0 110.295 177.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -106.39 18.72 21.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.504 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . 0.556 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.42 152.05 94.07 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.445 -178.439 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 11.2 Cg_endo -54.92 -29.36 63.54 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.231 2.62 . . . . 0.0 112.791 -178.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.712 ' HB2' ' HD2' ' A' ' 34' ' ' LYS . 1.3 m-20 -60.92 -34.78 75.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.338 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LYS . . . . . 0.712 ' HD2' ' HB2' ' A' ' 33' ' ' ASP . 0.1 OUTLIER -108.11 18.06 21.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.719 -178.256 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ASN . . . . . 0.611 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.4 t-20 -116.18 136.27 22.98 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.097 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 53.1 Cg_endo -85.73 -121.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.947 2.432 . . . . 0.0 112.723 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . 0.413 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 43.7 m-20 -97.44 -9.17 27.77 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.894 0.378 . . . . 0.0 111.137 -177.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.34 101.95 11.46 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 51.4 mttm -99.42 -21.04 16.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -57.27 -42.89 82.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -67.35 -35.6 79.72 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.829 0.347 . . . . 0.0 110.309 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.55 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 24.3 mt-10 -69.44 -42.24 75.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 109.825 176.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 46.8 tptt -57.67 -46.7 83.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.705 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 65.1 mmtt -66.0 -35.49 80.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.29 -39.9 89.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.789 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . 0.432 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 95.2 mttt -66.7 -44.21 82.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.222 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 16.5 mm-40 -65.11 -41.5 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 p -71.04 -37.3 66.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.603 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.15 92.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.607 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 9.6 pt-20 -71.36 -41.6 69.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.173 0.511 . . . . 0.0 110.372 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ALA . . . . . 0.727 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -68.65 -42.7 77.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.534 -174.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -38.31 71.35 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -69.89 -43.45 71.75 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.511 -175.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . 0.57 HG21 ' HD2' ' A' ' 62' ' ' ARG . 11.8 p -68.27 -37.23 77.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.588 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 0.636 HD11 ' O ' ' A' ' 56' ' ' LEU . 1.9 tm? -72.17 -26.0 61.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.907 0.384 . . . . 0.0 110.327 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 t -76.32 -19.85 57.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.076 -174.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.621 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 23.1 t70 -112.36 121.63 45.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.42 0.629 . . . . 0.0 109.916 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.903 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.68 -37.22 85.88 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.99 -174.441 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 47.0 t60 -68.91 -39.54 79.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.287 -179.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . 0.621 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 41.5 mmtm -60.96 -36.15 78.64 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.219 177.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ARG . . . . . 0.57 ' HD2' HG21 ' A' ' 55' ' ' VAL . 9.8 mmm180 -63.81 -46.39 85.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.2 pt-20 -65.43 -38.85 91.12 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.718 -0.393 . . . . 0.0 109.983 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ILE . . . . . 0.497 HD12 ' HD3' ' A' ' 67' ' ' ARG . 44.5 mm -67.8 -44.09 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.551 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -60.93 -42.79 98.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.259 -176.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.29 -42.06 62.85 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . 0.497 ' HD3' HD12 ' A' ' 64' ' ' ILE . 8.0 ptm180 -72.17 -30.9 65.44 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 111.452 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.423 ' HB3' ' O ' ' A' ' 64' ' ' ILE . 0.1 OUTLIER -103.96 -6.13 21.54 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.421 0.629 . . . . 0.0 110.943 -174.446 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.47 -48.99 67.79 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.472 -0.785 . . . . 0.0 113.619 -178.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -58.4 -46.23 86.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -176.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.394 -0.813 . . . . 0.0 110.513 -179.521 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.404 ' C ' ' H ' ' A' ' 4' ' ' TYR . . . -109.87 -44.68 3.77 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.011 0.434 . . . . 0.0 110.523 176.432 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 m 67.64 -7.12 0.6 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.308 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.622 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 30.2 t80 -59.13 -35.34 73.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -177.163 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -56.82 -42.61 79.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.139 0.495 . . . . 0.0 110.21 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -74.63 -45.09 47.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.928 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.766 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.2 pp -72.8 -40.88 61.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -167.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.438 ' HB3' ' H ' ' A' ' 9' ' ' ASP . 0.1 OUTLIER -101.67 -106.08 0.25 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.322 -169.127 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.471 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 26.6 t70 -140.53 -35.71 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.84 -171.315 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.539 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 31.6 m -129.79 162.08 55.62 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.693 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.539 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.8 Cg_endo -62.11 160.78 28.84 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.589 2.859 . . . . 0.0 113.108 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.596 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.6 106.74 11.85 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.909 0.861 . . . . 0.0 109.182 175.679 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -176.65 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 145.59 47.35 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.086 173.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -68.08 165.74 17.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.19 -177.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -51.88 -30.11 22.66 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.074 0.464 . . . . 0.0 111.843 -178.238 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.5 -44.39 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -68.84 -34.99 76.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.212 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.62 HG13 ' CZ ' ' A' ' 4' ' ' TYR . 1.9 mp -57.54 -47.8 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.673 176.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -65.83 -38.29 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.056 0.455 . . . . 0.0 110.126 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.41 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 1.2 tmtt? -69.68 -35.42 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.733 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.552 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -63.85 -35.86 82.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 110.462 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.539 ' HD1' HG23 ' A' ' 49' ' ' VAL . 4.1 t80 -64.01 -48.04 77.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.188 173.456 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 71.9 mtp180 -64.68 -43.25 94.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.357 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.552 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 8.9 ptp85 -65.21 -39.96 93.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.719 0.295 . . . . 0.0 110.439 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.466 ' HA ' ' HB3' ' A' ' 29' ' ' GLN . 24.1 ttmm -71.73 -35.81 70.27 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.573 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.87 -44.96 74.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.189 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.572 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 10.7 mp -71.48 -34.81 70.51 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.782 175.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.466 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 33.5 tt0 -61.66 -36.82 81.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.393 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.517 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 95.3 m95 -111.85 19.35 18.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.342 0.592 . . . . 0.0 110.82 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.617 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 27.7 t60 -72.14 145.04 88.07 Favored Pre-proline 0 C--N 1.322 -0.61 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.617 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.4 Cg_endo -54.21 -28.73 53.36 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.866 3.044 . . . . 0.0 113.633 -174.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.38 -25.17 65.83 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.123 0.487 . . . . 0.0 110.134 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.421 ' HB2' ' HZ2' ' A' ' 34' ' ' LYS . 0.0 OUTLIER -108.72 2.59 21.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.117 -175.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.567 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -104.04 140.29 20.93 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 120.939 0.399 . . . . 0.0 110.216 -176.108 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.6 Cg_endo -87.34 -119.52 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.047 2.498 . . . . 0.0 112.757 -178.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -86.91 -8.05 57.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.114 0.483 . . . . 0.0 111.157 -177.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.572 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 55.1 m-80 -102.47 102.95 13.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.242 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.541 ' HG3' HD22 ' A' ' 35' ' ' ASN . 0.1 OUTLIER -97.77 -31.07 12.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.949 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -61.75 -44.88 96.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.205 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.572 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 82.6 m-85 -66.79 -37.43 84.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.448 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -68.15 -45.99 72.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.029 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.3 pt-20 -70.3 -36.22 74.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.546 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 8.5 ttmm -59.53 -44.44 93.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 120.864 0.364 . . . . 0.0 110.147 178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.518 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 62.9 mmtt -68.12 -39.64 82.72 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -62.44 -41.59 98.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.377 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 51.3 mtmt -68.34 -44.11 76.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.749 -179.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.518 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 12.7 pt-20 -72.27 -36.28 68.97 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.539 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.8 p -67.21 -38.38 80.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.085 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.84 -44.46 96.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.446 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 11.5 pt-20 -72.7 -40.66 66.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.967 0.413 . . . . 0.0 111.083 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.766 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -72.04 -40.03 68.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.454 -175.011 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.507 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -69.28 -34.23 74.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 175.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.46 -50.26 74.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.901 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.585 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 3.2 m -67.93 -40.98 84.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.414 HD13 ' HD2' ' A' ' 62' ' ' ARG . 31.1 tp -73.1 -28.83 62.5 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.169 -0.612 . . . . 0.0 112.06 -175.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.9 t -77.98 -22.63 49.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.784 0.326 . . . . 0.0 110.228 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.833 ' HB3' ' HG3' ' A' ' 61' ' ' LYS . 11.7 t70 -112.41 121.67 45.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.082 0.468 . . . . 0.0 109.747 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.501 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 3.0 mptp? -66.56 -34.99 79.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.005 -170.175 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.498 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.5 t-80 -69.68 -42.16 74.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.517 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.833 ' HG3' ' HB3' ' A' ' 58' ' ' ASP . 4.6 mtpt -60.49 -33.76 73.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.623 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 14.9 mtm105 -60.63 -46.67 89.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.03 0.443 . . . . 0.0 110.654 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 14.8 pt-20 -71.84 -30.12 65.13 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.592 -176.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.789 HD12 ' HD3' ' A' ' 67' ' ' ARG . 47.8 mm -63.65 -38.02 81.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.967 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -65.24 -39.92 93.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.277 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -72.83 -45.73 56.8 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.789 ' HD3' HD12 ' A' ' 64' ' ' ILE . 9.0 ptm180 -71.61 -41.71 68.56 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 122.33 -0.231 . . . . 0.0 111.388 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.01 -0.46 57.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.512 0.673 . . . . 0.0 109.773 -174.216 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.59 -48.76 8.66 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 166.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -65.75 -45.51 82.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.431 -0.885 . . . . 0.0 111.585 175.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.953 179.146 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.2 ttp . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.646 0.26 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.37 -36.34 60.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.769 0.318 . . . . 0.0 111.247 -177.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.1 m 66.62 -2.28 1.11 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.225 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.477 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -61.32 -36.85 81.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.862 -178.964 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.539 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 2.1 p90 -57.35 -39.3 75.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.153 175.448 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.539 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 8.0 mm-40 -73.88 -44.36 55.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.463 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.674 HD12 HD11 ' A' ' 56' ' ' LEU . 2.3 pp -71.15 -31.73 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.715 -173.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.7 tp -97.39 -78.37 0.48 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.801 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 177.56 -44.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.251 0.548 . . . . 0.0 110.222 -175.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.416 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 27.5 m -120.5 156.14 55.92 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.642 -170.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.521 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 87.1 Cg_endo -81.74 174.66 10.13 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.201 2.6 . . . . 0.0 112.042 176.876 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.3 ptm85 -78.05 -8.92 58.82 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.392 -174.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 m -69.35 -13.85 62.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.082 0.467 . . . . 0.0 110.776 176.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.98 144.27 28.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.6 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 m -72.74 163.59 27.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.738 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.28 -40.14 61.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -173.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.15 -34.52 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.358 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.415 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 21.1 t70 -69.66 -40.03 76.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.448 ' H ' HD12 ' A' ' 19' ' ' ILE . 2.3 mp -61.81 -40.93 88.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.825 172.433 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.874 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 26.7 ttpp -57.59 -43.33 84.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.556 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.758 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.2 mmpt? -63.54 -35.98 82.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.537 174.811 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.495 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.55 -47.88 77.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.874 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 12.4 p90 -70.09 -36.93 75.26 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.894 -0.722 . . . . 0.0 109.849 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.42 ' O ' HD12 ' A' ' 28' ' ' LEU . 1.8 mmt180 -57.52 -45.7 84.69 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.893 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 6.3 ptp180 -67.07 -39.18 86.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.797 0.332 . . . . 0.0 110.514 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -64.76 -38.27 90.42 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.92 -36.27 80.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.074 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.457 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 6.4 mp -69.68 -36.21 75.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.404 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.23 -37.4 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.769 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -108.22 20.27 18.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.808 0.337 . . . . 0.0 111.064 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.522 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.2 t-80 -72.02 140.67 83.38 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.522 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 9.3 Cg_endo -53.07 -37.28 79.02 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.731 2.287 . . . . 0.0 113.327 -167.028 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -67.88 -26.49 66.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 111.162 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.467 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 12.9 mmtp -107.34 15.12 25.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.498 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -107.76 134.33 20.1 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.365 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -81.26 -120.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 122.951 2.434 . . . . 0.0 113.251 -175.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 20.9 m-20 -97.04 -9.33 28.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 111.613 -173.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.43 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.9 m120 -100.69 101.62 12.54 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.5 OUTLIER -93.53 -29.63 15.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.314 -174.581 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -54.43 -44.84 72.77 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.549 0.531 . . . . 0.0 110.979 -174.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.461 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 89.9 m-85 -62.61 -43.11 99.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.03 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.84 96.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.016 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.563 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 15.7 mt-10 -69.56 -44.14 71.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.024 0.44 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -64.98 -41.48 95.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.287 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.461 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 66.5 mmtt -71.69 -34.57 69.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.661 0.267 . . . . 0.0 110.333 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -60.76 -39.27 88.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.085 0.469 . . . . 0.0 109.751 174.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.94 -45.77 84.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.488 174.718 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -63.74 -43.93 95.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.467 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.482 ' CG2' ' HB2' ' A' ' 23' ' ' TYR . 11.2 p -67.35 -36.72 77.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.782 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.674 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . . . -63.87 -45.77 87.93 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.91 0.386 . . . . 0.0 111.74 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -70.69 -36.8 73.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.544 0.688 . . . . 0.0 109.979 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -73.97 -45.94 47.06 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.662 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.674 ' CD2' ' HA ' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.13 -34.77 78.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.998 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -51.24 68.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.322 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG13 ' HA ' ' A' ' 52' ' ' ALA . 14.6 p -71.84 -39.09 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.674 HD11 HD12 ' A' ' 7' ' ' ILE . 46.6 mt -68.47 -24.29 64.68 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -172.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.8 t -78.3 -23.11 47.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.907 0.385 . . . . 0.0 110.36 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -114.33 121.58 44.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.0 111.027 -177.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.457 ' HG2' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -65.28 -36.25 83.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.691 -178.064 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.457 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 32.2 m-70 -69.14 -41.86 76.76 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.853 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.418 ' HE3' ' HB2' ' A' ' 61' ' ' LYS . 26.7 ttmt -63.09 -33.78 76.18 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.07 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -62.13 -37.14 84.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.821 174.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 41.5 mt-10 -63.38 -43.08 98.62 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.114 0.483 . . . . 0.0 110.175 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.14 -44.93 95.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -66.19 -35.36 80.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.19 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.8 -47.38 69.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -82.67 -41.28 19.58 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -93.19 9.91 34.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.561 0.696 . . . . 0.0 110.112 -171.666 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -87.03 -47.59 4.68 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 169.886 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -66.7 -42.36 86.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.366 -0.917 . . . . 0.0 110.659 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 C--O 1.246 0.921 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.457 ' HB2' ' CD2' ' A' ' 4' ' ' TYR . . . 70.59 -72.69 0.11 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.675 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m 60.06 26.59 15.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.98 0.419 . . . . 0.0 111.665 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.514 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.2 m-85 -68.5 -33.71 74.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.112 0.482 . . . . 0.0 110.458 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.79 -35.07 78.65 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.518 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -74.55 -43.97 53.23 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.138 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.655 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.6 pp -69.51 -40.96 80.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -174.067 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 32.6 tp -102.58 -104.02 0.28 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.011 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.596 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 7.2 m-20 -158.48 -22.65 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.125 -177.223 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.61 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.4 m -118.48 158.52 46.74 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.647 -176.586 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.61 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.3 Cg_endo -59.3 -81.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.079 2.519 . . . . 0.0 114.118 -172.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.458 ' HA ' HD11 ' A' ' 56' ' ' LEU . 37.8 ptt180 -171.32 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -177.393 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.5 t -97.25 27.41 4.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.304 0.573 . . . . 0.0 110.455 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' HB3' HD13 ' A' ' 19' ' ' ILE . . . -81.44 145.92 30.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.497 178.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.5 m -55.37 128.58 34.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . 0.595 ' O ' ' HG2' ' A' ' 20' ' ' LYS . . . -53.23 -33.75 54.22 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -170.644 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.75 -34.8 77.95 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.878 0.371 . . . . 0.0 110.753 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.82 -35.81 77.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.754 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.83 HG22 ' HB2' ' A' ' 57' ' ' SER . 2.4 mp -59.72 -42.68 89.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.733 170.889 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.595 ' HG2' ' O ' ' A' ' 16' ' ' ALA . 71.0 mmtt -61.22 -37.91 84.72 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.562 175.384 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.596 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.63 -47.44 78.54 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.26 176.749 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' HB1' ' HB2' ' A' ' 9' ' ' ASP . . . -60.63 -39.57 88.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.136 0.494 . . . . 0.0 110.466 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.689 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -67.57 -50.0 60.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.486 176.684 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtt85 -68.36 -37.78 80.79 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.401 HH11 ' HD3' ' A' ' 25' ' ' ARG . 8.4 ttt-85 -62.12 -44.44 96.64 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.973 0.416 . . . . 0.0 110.742 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.612 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.2 ttmm -66.46 -42.34 87.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 110.078 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.99 84.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.293 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.435 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -66.86 -37.05 83.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.538 -177.98 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -64.12 -34.82 78.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 0.0 110.925 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -106.45 19.3 20.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.288 0.566 . . . . 0.0 110.546 179.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.508 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.27 152.2 94.38 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.356 -178.427 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.508 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.1 Cg_endo -54.81 -30.09 66.01 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.492 2.128 . . . . 0.0 112.074 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.8 -24.38 62.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.899 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.412 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 0.2 OUTLIER -115.43 -3.42 12.42 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -173.645 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.421 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 29.9 p30 -103.54 140.25 20.88 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.262 0.554 . . . . 0.0 110.458 -176.12 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 55.5 Cg_endo -92.19 -104.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.155 2.57 . . . . 0.0 112.85 -177.863 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -98.12 -7.21 30.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.84 0.352 . . . . 0.0 111.854 -176.445 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -94.34 100.91 12.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 0.0 110.182 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -101.63 -29.54 11.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.52 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.85 -43.6 90.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.227 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -71.02 -37.48 72.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.627 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.5 -43.87 95.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.949 -179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.584 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 10.2 pt-20 -69.55 -38.94 77.68 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.323 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -59.76 -47.8 84.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.684 0.278 . . . . 0.0 110.949 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.488 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 67.1 mmtt -65.09 -35.22 80.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.687 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -67.08 -40.73 87.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.475 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 88.2 mttt -68.36 -46.52 69.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.488 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 11.9 pt-20 -67.29 -37.49 83.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.376 -175.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.689 HG23 ' HD1' ' A' ' 23' ' ' TYR . 14.7 p -71.8 -37.72 63.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.334 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -44.37 94.59 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.336 -178.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.96 -40.92 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.19 0.519 . . . . 0.0 110.603 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.655 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -75.2 -38.93 60.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.083 -175.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.5 -35.75 68.23 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.45 -45.55 90.35 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.399 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.724 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 11.1 p -70.23 -41.07 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.738 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.458 HD11 ' HA ' ' A' ' 12' ' ' ARG . 58.4 tp -74.31 -30.93 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.239 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' SER . . . . . 0.83 ' HB2' HG22 ' A' ' 19' ' ' ILE . 32.1 t -81.72 -21.17 38.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.731 0.301 . . . . 0.0 110.98 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.535 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 20.2 t70 -111.83 124.46 52.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 -174.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -66.93 -32.19 73.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.489 ' O ' HG12 ' A' ' 64' ' ' ILE . 43.0 m-70 -68.39 -41.89 79.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 177.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.724 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 5.9 mptp? -61.51 -36.71 81.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.568 174.349 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.535 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 46.8 mmm-85 -59.94 -40.8 90.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.059 0.457 . . . . 0.0 109.842 174.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.51 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 44.1 mt-10 -65.22 -40.17 93.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.996 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 60' ' ' HIS . 42.4 mm -64.43 -44.45 97.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.776 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.05 -37.33 87.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.914 0.388 . . . . 0.0 110.501 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.08 -45.09 95.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -88.73 -48.05 7.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -94.64 -9.74 34.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.861 0.362 . . . . 0.0 111.248 -170.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.16 -44.63 97.46 Favored Glycine 0 CA--C 1.506 -0.479 0 N-CA-C 111.198 -0.761 . . . . 0.0 111.198 175.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -66.7 -34.28 77.5 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.25 -0.975 . . . . 0.0 111.559 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.957 -177.569 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.772 0.32 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.428 ' C ' ' H ' ' A' ' 4' ' ' TYR . . . 56.68 72.65 0.49 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.047 -179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m -68.75 3.62 1.83 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.411 0.625 . . . . 0.0 110.793 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.554 ' HA ' HG13 ' A' ' 7' ' ' ILE . 98.7 m-85 -68.79 -23.86 64.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.559 176.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -56.59 -33.01 65.8 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.0 -44.37 61.11 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.411 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.809 HD12 ' HB2' ' A' ' 52' ' ' ALA . 2.7 pp -71.8 -39.18 67.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.826 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.48 ' N ' HD13 ' A' ' 7' ' ' ILE . 38.4 tp -100.59 -90.56 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 171.1 -16.04 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.513 0.725 . . . . 0.0 109.924 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.98 152.46 56.48 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.975 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -87.59 165.49 7.76 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.907 2.405 . . . . 0.0 112.524 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.784 ' HB3' HD13 ' A' ' 56' ' ' LEU . 11.0 ptm180 -70.15 -3.91 18.98 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.472 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 t -56.02 -33.5 64.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.261 172.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.34 146.03 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.423 177.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.8 p -63.76 155.81 29.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.231 177.579 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.84 64.11 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -170.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.488 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 21.7 m-20 -62.7 -34.42 77.1 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.979 0.418 . . . . 0.0 111.346 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -62.41 -41.37 98.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.865 178.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.441 HG23 HD22 ' A' ' 8' ' ' LEU . 1.9 mp -62.61 -39.19 83.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.6 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.488 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 90.9 mttt -58.24 -41.29 83.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.251 177.585 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -68.88 -36.01 77.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.509 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.42 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.34 -35.96 82.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.23 0.538 . . . . 0.0 110.075 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.817 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -65.67 -43.6 88.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.835 174.56 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -68.22 -38.51 81.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.764 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.42 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 4.0 ptm180 -69.37 -36.7 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.902 0.382 . . . . 0.0 110.488 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.504 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 21.2 ttmm -70.92 -42.48 69.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 121.163 0.506 . . . . 0.0 109.769 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.38 -45.82 84.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.946 176.326 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.71 -37.32 83.72 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.936 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -65.63 -31.19 72.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.337 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.449 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 98.6 m95 -105.4 13.37 30.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.069 0.461 . . . . 0.0 111.462 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -82.04 147.75 58.58 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.54 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.474 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 12.2 Cg_endo -54.25 -29.4 56.97 Favored 'Trans proline' 0 N--CA 1.477 0.501 0 C-N-CA 124.27 3.313 . . . . 0.0 113.625 -167.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -64.2 -30.59 71.64 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.105 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -111.56 7.55 20.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.505 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 27.0 t-20 -107.98 140.06 21.28 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.467 -176.811 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.453 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 91.4 Cg_endo -78.02 -117.76 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.863 2.375 . . . . 0.0 112.753 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.453 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 2.5 m-20 -97.11 -7.03 33.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.589 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 16.8 m120 -103.59 99.02 8.82 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.206 -173.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HE3' ' HA ' ' A' ' 32' ' ' PRO . 46.0 mmtm -93.06 -25.77 17.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.867 177.668 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 7.8 tm-20 -60.85 -44.08 97.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.666 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.589 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 54.7 m-85 -71.97 -37.83 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 175.896 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.505 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.87 -46.21 88.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.641 0.258 . . . . 0.0 111.184 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -69.32 -35.63 76.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 5.1 tttp -58.77 -48.43 81.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.629 177.072 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -72.01 -34.99 69.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.911 -178.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.98 -40.19 92.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.243 0.544 . . . . 0.0 109.689 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -67.37 -45.87 75.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.467 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.79 -43.3 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.635 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.817 HG23 ' HD1' ' A' ' 23' ' ' TYR . 12.0 p -67.89 -37.4 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.909 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.73 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.775 0.322 . . . . 0.0 111.263 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.08 -36.85 69.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.078 0.466 . . . . 0.0 110.525 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.809 ' HB2' HD12 ' A' ' 7' ' ' ILE . . . -75.62 -38.53 58.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.091 -173.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -36.08 72.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -65.03 -47.08 78.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.612 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.606 ' HA ' ' CB ' ' A' ' 61' ' ' LYS . 11.8 p -64.68 -38.71 83.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.37 . . . . 0.0 111.145 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.784 HD13 ' HB3' ' A' ' 12' ' ' ARG . 48.1 tp -74.08 -29.15 61.72 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.7 t -84.19 -19.55 33.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.495 0.188 . . . . 0.0 111.205 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.595 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 23.3 t70 -112.36 129.99 56.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.383 0.611 . . . . 0.0 111.56 -174.606 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.658 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.69 -36.06 81.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.153 -175.425 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.4 ' O ' HD13 ' A' ' 64' ' ' ILE . 35.5 m170 -69.75 -41.89 74.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.128 0.49 . . . . 0.0 110.227 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.798 ' HA ' ' HE2' ' A' ' 61' ' ' LYS . 10.5 mmpt? -61.15 -37.76 84.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.603 176.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.595 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 89.0 mtt180 -61.77 -47.22 86.17 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.758 0.313 . . . . 0.0 111.427 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -71.39 -35.8 71.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.611 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.411 ' HA ' ' HG2' ' A' ' 67' ' ' ARG . 1.6 mp -65.11 -39.19 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.62 -38.02 83.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.401 . . . . 0.0 110.629 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -73.08 -47.72 42.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.453 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.411 ' HG2' ' HA ' ' A' ' 64' ' ' ILE . 8.6 ptm180 -77.01 -30.93 56.06 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -173.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -94.85 -10.14 32.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.286 0.565 . . . . 0.0 110.053 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.64 -47.27 10.25 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.312 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -62.82 -27.64 69.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.003 -0.598 . . . . 0.0 111.832 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.464 -0.779 . . . . 0.0 111.376 -176.526 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.875 0.369 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.17 138.24 3.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.173 0.511 . . . . 0.0 111.472 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.9 p -72.0 -28.64 63.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.191 173.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.513 ' O ' HG13 ' A' ' 7' ' ' ILE . 57.2 m-85 -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.794 176.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.38 -32.7 73.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.427 176.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -73.36 -44.03 59.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.07 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.513 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.5 pp -70.22 -40.54 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.38 -176.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.424 HD23 ' HB2' ' A' ' 22' ' ' ALA . 20.2 tp -102.29 -93.08 0.31 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.049 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.401 ' H ' ' HB3' ' A' ' 8' ' ' LEU . 4.5 p30 174.27 3.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.021 0.826 . . . . 0.0 110.771 173.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.421 HG21 HD21 ' A' ' 8' ' ' LEU . 17.0 m -121.11 154.39 58.26 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-O 120.643 0.258 . . . . 0.0 110.985 176.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.41 161.7 43.74 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.181 2.587 . . . . 0.0 112.619 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.535 ' HD3' ' N ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -68.6 -20.4 64.5 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.501 -175.083 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.535 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 21.0 m -77.32 -2.51 35.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.328 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.688 ' HB2' ' HB2' ' A' ' 18' ' ' ASP . . . -74.22 143.49 45.11 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.338 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -86.04 173.01 10.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.993 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.23 -39.7 60.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -64.84 -41.16 95.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.338 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.688 ' HB2' ' HB2' ' A' ' 14' ' ' ALA . 3.3 m-20 -62.01 -44.12 97.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.248 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.622 HG21 ' HD2' ' A' ' 53' ' ' TYR . 1.9 mp -63.92 -38.67 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.456 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -36.08 80.82 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.798 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.715 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.1 mmpt? -64.07 -46.62 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.122 175.65 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.424 ' HB2' HD23 ' A' ' 8' ' ' LEU . . . -63.74 -37.51 87.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 110.591 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.695 ' HD1' HG23 ' A' ' 49' ' ' VAL . 2.7 t80 -63.02 -46.7 86.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.792 175.155 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -67.55 -37.2 82.33 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -176.409 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -67.89 -40.76 83.48 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.177 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.915 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.6 ttmm -70.23 -42.5 72.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.371 0.605 . . . . 0.0 109.56 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.55 -44.7 85.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.399 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.5 -46.25 90.79 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.391 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -63.09 -31.54 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.139 -177.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.693 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 89.1 m95 -106.09 18.89 21.37 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.077 0.465 . . . . 0.0 111.323 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m170 -83.65 143.75 44.46 Favored Pre-proline 0 C--N 1.32 -0.675 0 O-C-N 122.069 -0.395 . . . . 0.0 110.165 173.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.0 -25.92 56.29 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.671 2.914 . . . . 0.0 111.941 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -59.73 -33.63 71.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.21 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -113.68 -29.88 6.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.611 HD21 ' HB2' ' A' ' 42' ' ' ALA . 65.7 t30 -102.44 132.5 21.32 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.597 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 74.2 Cg_endo -73.61 -115.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.982 2.454 . . . . 0.0 115.699 -167.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -85.91 -7.2 58.85 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -165.287 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -101.62 98.41 8.71 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.38 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -103.92 -23.13 13.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.767 -176.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.547 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 21.5 tt0 -66.26 -41.02 90.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.299 0.571 . . . . 0.0 110.601 -178.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.34 -37.46 83.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.83 177.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.693 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -66.66 -44.39 81.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.029 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.547 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 12.9 pt-20 -67.34 -36.46 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.75 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -60.05 -40.85 90.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.715 0.293 . . . . 0.0 110.706 174.331 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.403 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 68.2 mmtt -71.84 -35.25 69.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.799 0.333 . . . . 0.0 110.565 177.697 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.44 -39.33 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.718 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -65.31 -41.72 93.77 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.431 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.28 -43.2 98.6 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.473 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.915 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 6.7 p -70.42 -38.84 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.524 178.132 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.43 -45.07 95.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.554 0.216 . . . . 0.0 111.58 -178.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.447 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.0 pt-20 -71.91 -43.63 65.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.017 0.437 . . . . 0.0 111.032 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.63 67.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.43 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.622 ' HD2' HG21 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -70.63 -33.66 71.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -60.68 -42.31 96.84 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.535 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.752 HG11 ' HG3' ' A' ' 61' ' ' LYS . 64.3 t -69.04 -44.81 80.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.001 0.429 . . . . 0.0 110.566 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.543 ' HG ' HG12 ' A' ' 19' ' ' ILE . 40.3 tp -72.25 -17.48 61.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.323 -175.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.8 m -82.83 -18.39 40.61 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 122.043 -0.41 . . . . 0.0 111.922 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -109.01 123.4 49.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.202 0.525 . . . . 0.0 111.482 -175.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -61.08 -38.01 84.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.653 -177.734 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.414 ' O ' HD11 ' A' ' 64' ' ' ILE . 80.6 t60 -65.12 -40.51 94.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.752 ' HG3' HG11 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -70.28 -33.63 71.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.382 177.698 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.74 -47.46 83.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.097 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.404 ' O ' ' HG2' ' A' ' 67' ' ' ARG . 9.4 pt-20 -71.32 -34.96 71.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.863 -177.204 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.414 HD11 ' O ' ' A' ' 60' ' ' HIS . 1.5 mp -65.04 -42.5 94.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -65.62 -36.73 84.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.978 0.418 . . . . 0.0 110.225 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.19 -47.84 78.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.661 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.669 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 10.8 ptm180 -88.58 -48.86 7.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -94.3 -10.56 32.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.92 0.391 . . . . 0.0 111.176 -168.426 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.4 -49.32 6.29 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.474 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -67.42 -25.52 65.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.673 -0.763 . . . . 0.0 112.751 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.669 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 75.4 mm-40 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.929 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.97 145.04 2.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.873 0.368 . . . . 0.0 110.795 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m -81.25 -12.92 58.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.802 ' HA ' HG12 ' A' ' 7' ' ' ILE . 66.8 m-85 -68.44 -26.12 65.36 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.67 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.0 -39.31 81.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.667 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -73.51 -44.21 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.847 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.837 HD11 ' HB2' ' A' ' 52' ' ' ALA . 12.4 pt -71.81 -42.31 69.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -172.488 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.498 ' N ' HG13 ' A' ' 7' ' ' ILE . 15.6 mt -103.85 -75.3 0.62 Allowed 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 120.966 0.412 . . . . 0.0 109.937 176.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 168.95 -30.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.514 -174.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.0 m -120.66 154.12 56.98 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.9 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.76 -178.63 4.54 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.994 2.463 . . . . 0.0 112.616 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.85 -17.58 61.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.99 0.424 . . . . 0.0 111.346 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -23.42 66.7 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.562 175.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 145.84 44.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.914 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.2 m -67.63 159.78 29.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.978 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.04 -36.27 60.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.179 0.514 . . . . 0.0 111.223 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -61.5 -40.28 94.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.812 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -62.2 -44.61 96.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.657 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.85 -45.73 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.748 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.5 ttmm -60.83 -40.85 94.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.773 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.487 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 9.6 mmmm -70.33 -35.56 73.69 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.92 -41.58 96.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.268 0.556 . . . . 0.0 109.642 173.375 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.65 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -65.47 -44.11 88.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.012 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -61.88 -41.16 97.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.748 0.309 . . . . 0.0 111.629 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -67.48 -44.12 79.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.503 . . . . 0.0 110.952 175.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.531 ' CG ' ' HB ' ' A' ' 49' ' ' VAL . 3.6 tppp? -60.35 -38.59 84.29 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.311 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.693 ' HA ' ' NE1' ' A' ' 30' ' ' TRP . . . -60.62 -42.13 96.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.995 175.192 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.4 -35.4 73.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.65 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.403 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 24.2 mm-40 -60.38 -33.37 72.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.275 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.693 ' NE1' ' HA ' ' A' ' 27' ' ' ALA . 64.1 p-90 -106.46 6.42 30.24 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.626 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.1 m170 -74.2 146.99 85.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.549 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 17.0 Cg_endo -55.67 -28.1 64.3 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.758 2.972 . . . . 0.0 112.687 -176.885 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.82 -24.38 63.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.124 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -119.16 -10.87 9.69 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.549 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -104.44 133.86 19.98 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.449 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 92.1 Cg_endo -96.56 -112.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.394 2.73 . . . . 0.0 113.096 -177.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -85.23 -6.75 59.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.61 0.719 . . . . 0.0 110.065 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.758 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.2 m120 -90.66 103.09 15.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.731 -174.599 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -98.2 -29.32 13.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.091 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.523 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 34.1 tt0 -59.71 -44.69 93.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.133 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.758 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 93.4 m-85 -65.04 -37.65 88.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.913 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.25 -44.7 94.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.188 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.04 -37.95 75.72 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.748 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 55.7 mtpt -63.75 -46.29 85.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.616 0.246 . . . . 0.0 110.99 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.619 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 30.1 mmtp -66.55 -34.68 78.44 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.32 -50.89 71.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.077 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.463 ' HB2' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -69.08 -43.15 75.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.103 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.619 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 9.1 pt-20 -64.83 -37.31 87.19 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.971 -175.291 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.65 HG23 ' HD1' ' A' ' 23' ' ' TYR . 13.1 p -72.42 -38.94 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 C-N-CA 120.139 -0.625 . . . . 0.0 110.869 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.33 -45.41 91.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 11.1 pt-20 -72.02 -43.16 65.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.058 -179.17 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.837 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -75.07 -42.48 56.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.177 -173.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.501 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 4.1 t80 -70.89 -35.57 72.39 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.215 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.96 -50.46 68.54 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.01 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.541 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.6 p -62.55 -41.3 91.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -175.668 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 tp -75.18 -28.96 60.24 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.1 m -85.9 -19.44 30.53 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.777 0.322 . . . . 0.0 111.043 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -102.51 124.22 47.68 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.593 0.711 . . . . 0.0 110.767 -177.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.659 ' N ' ' HD2' ' A' ' 59' ' ' LYS . 8.0 mptt -68.86 -31.43 70.37 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.154 -175.175 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.601 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 87.9 m-70 -70.44 -43.83 69.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.187 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.541 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -65.08 -34.42 78.38 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 175.127 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 mmm180 -59.25 -41.66 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.625 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.601 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 41.7 mt-10 -60.59 -43.37 97.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.827 0.346 . . . . 0.0 110.799 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.36 -44.93 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -66.18 -35.25 79.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.234 0.54 . . . . 0.0 110.413 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.89 -45.79 87.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.611 -177.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -88.46 -37.56 15.71 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -101.0 9.87 41.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 0.0 111.495 -171.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.77 -56.43 4.15 Favored Glycine 0 CA--C 1.508 -0.369 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.53 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -66.62 -36.63 83.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.154 -0.523 . . . . 0.0 112.064 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.793 -0.623 . . . . 0.0 111.012 -176.734 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.664 0.269 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.18 -48.09 0.36 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.792 0.33 . . . . 0.0 111.079 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.3 p 58.61 0.69 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.487 1.115 . . . . 0.0 113.822 175.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.483 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 38.2 m-85 -68.82 -27.05 65.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.176 0.513 . . . . 0.0 110.971 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.592 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 1.3 p90 -66.78 -32.7 74.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.489 173.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -74.25 -43.83 55.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.124 177.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.483 ' CG1' ' HA ' ' A' ' 4' ' ' TYR . 2.5 pp -71.6 -33.21 48.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.781 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.425 HD22 HG23 ' A' ' 19' ' ' ILE . 54.0 tp -99.36 -79.69 0.48 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.966 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 176.35 -41.02 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.16 -175.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 m -122.99 151.55 61.52 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.197 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.592 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 27.4 Cg_endo -64.37 151.39 85.69 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.137 2.558 . . . . 0.0 112.166 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -73.38 -15.03 61.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.21 -172.014 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.9 m -62.2 -18.88 62.32 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.937 174.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.435 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -73.49 145.94 45.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.8 t -66.12 161.7 21.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.458 -177.002 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.5 50.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.202 0.525 . . . . 0.0 110.665 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -60.72 -41.89 96.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.411 178.201 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.435 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 10.5 m-20 -68.28 -41.24 81.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.497 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.607 HG21 ' HD1' ' A' ' 53' ' ' TYR . 1.7 mp -60.77 -42.85 93.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.932 174.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -62.0 -40.86 97.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.409 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.66 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.5 mmpt? -63.08 -40.97 99.24 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.4 176.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -60.45 -46.13 91.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.096 0.474 . . . . 0.0 110.258 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.491 ' HD1' HG23 ' A' ' 49' ' ' VAL . 4.1 t80 -61.94 -48.59 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.8 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.95 78.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.446 HH11 ' HD3' ' A' ' 25' ' ' ARG . 18.6 ttt-85 -60.58 -44.06 96.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.997 177.676 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.758 ' HD2' HG21 ' A' ' 49' ' ' VAL . 58.4 mttm -67.72 -37.19 81.9 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.267 0.556 . . . . 0.0 109.922 177.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.48 75.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.708 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 3.5 mm? -71.89 -35.78 69.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.01 0.433 . . . . 0.0 111.047 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.01 -38.78 89.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.847 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -109.61 20.69 17.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.348 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.479 ' HB2' ' HA ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -69.29 145.69 96.07 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.382 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.412 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 10.5 Cg_endo -53.52 -34.34 72.0 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 122.355 2.037 . . . . 0.0 113.098 -168.528 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.91 -24.17 63.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.072 0.463 . . . . 0.0 110.969 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -113.87 7.89 17.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.99 145.77 31.19 Favored Pre-proline 0 C--O 1.234 0.286 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.058 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.0 Cg_endo -81.44 -120.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.941 2.428 . . . . 0.0 112.949 -174.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -97.11 -8.15 30.91 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.866 0.365 . . . . 0.0 111.218 -176.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -98.61 100.63 11.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.951 0.405 . . . . 0.0 110.26 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.522 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 13.8 mptt -92.61 -30.67 15.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.314 175.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.401 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 15.5 tp10 -60.84 -43.94 97.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.897 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -72.32 -38.29 68.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.586 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.32 90.83 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 11.2 pt-20 -71.22 -37.76 72.04 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.907 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 20.6 tptp -61.12 -45.96 92.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.549 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 31.9 mmtp -65.96 -38.14 87.82 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.995 178.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -62.15 -40.08 94.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.653 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.422 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.4 mmtt -66.74 -41.77 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.856 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.32 -44.12 92.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.001 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.758 HG21 ' HD2' ' A' ' 26' ' ' LYS . 7.3 p -72.03 -38.28 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.007 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.08 95.6 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.213 -0.195 . . . . 0.0 111.37 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -72.05 -40.27 68.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.0 110.728 -179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.39 -38.96 68.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.633 -174.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.607 ' HD1' HG21 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.84 -40.48 72.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.935 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -62.12 -49.88 74.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.012 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.02 -38.08 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 111.306 -177.49 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.0 tp -72.99 -26.26 61.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.772 0.32 . . . . 0.0 111.418 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -82.06 -18.8 41.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.674 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.468 ' HB3' ' HB2' ' A' ' 61' ' ' LYS . 17.6 t70 -110.35 122.2 47.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 0.0 110.318 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.522 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -66.35 -34.33 77.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.427 -174.833 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.522 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 33.6 t60 -71.97 -40.51 68.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.468 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.13 -34.32 77.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.972 177.339 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.407 ' O ' ' HB2' ' A' ' 66' ' ' ASP . 0.8 OUTLIER -60.15 -42.56 95.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.788 173.805 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.494 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 38.4 mt-10 -61.05 -44.71 96.98 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.176 0.512 . . . . 0.0 110.107 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 48.7 mm -68.82 -46.09 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.804 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -64.5 -35.91 82.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -177.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.407 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -70.32 -45.66 65.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.088 -174.241 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.578 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 9.1 ptm180 -85.61 -27.48 25.43 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.742 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.4 9.93 29.66 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.806 0.812 . . . . 0.0 109.792 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.82 -50.4 3.11 Favored Glycine 0 N--CA 1.442 -0.904 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.17 172.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -65.16 -46.92 78.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.755 -0.723 . . . . 0.0 111.812 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.578 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 9.5 pt-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.413 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.83 0.347 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.454 ' HB2' ' HD2' ' A' ' 4' ' ' TYR . . . -171.05 -49.7 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.9 t 69.34 -6.56 0.94 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.941 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.569 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 85.1 m-85 -62.54 -29.86 70.87 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.86 0.362 . . . . 0.0 111.52 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -34.78 78.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.914 0.388 . . . . 0.0 110.758 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -75.45 -43.87 47.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.899 176.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.614 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.7 pp -67.82 -38.37 80.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.882 0.372 . . . . 0.0 111.039 -177.234 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.1 tp -101.01 -93.97 0.28 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 175.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.484 ' OD1' HG11 ' A' ' 10' ' ' VAL . 4.5 p30 -178.72 -19.87 0.0 OUTLIER 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.58 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.484 HG11 ' OD1' ' A' ' 9' ' ' ASP . 16.2 m -118.74 150.9 49.24 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.984 0.421 . . . . 0.0 110.768 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -94.85 -178.12 0.53 Allowed 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 123.405 2.737 . . . . 0.0 112.982 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.3 ptt85 -64.66 -27.56 69.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.682 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.8 p -63.3 -20.49 65.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.448 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.521 ' HB2' HD13 ' A' ' 19' ' ' ILE . . . -80.33 146.98 31.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.54 178.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.6 t -50.56 141.68 12.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.137 175.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.64 -31.92 64.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.004 0.43 . . . . 0.0 110.699 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.478 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 7.3 m-20 -65.91 -34.61 78.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.766 174.351 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.42 -43.26 77.57 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.222 178.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.521 HD13 ' HB2' ' A' ' 14' ' ' ALA . 2.0 mp -60.26 -38.95 79.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.35 0.595 . . . . 0.0 109.862 173.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -65.32 -34.72 79.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.912 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.801 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.37 -43.23 95.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 173.606 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.79 93.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.105 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.667 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -62.09 -42.65 99.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.135 176.314 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -66.83 -43.6 83.31 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.523 -177.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -70.15 -32.2 70.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.127 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -61.17 -43.47 98.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.423 0.63 . . . . 0.0 109.973 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.79 71.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.96 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 7.7 mp -68.37 -36.53 79.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.868 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -62.17 -39.57 93.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.885 0.374 . . . . 0.0 111.153 -178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -108.42 18.77 20.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.326 0.584 . . . . 0.0 110.614 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.507 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 14.2 t-80 -71.86 139.32 82.87 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.965 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.507 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 14.7 Cg_endo -55.97 -32.22 84.96 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 123.912 3.075 . . . . 0.0 114.424 -170.203 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.66 -28.92 65.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.794 0.33 . . . . 0.0 110.605 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.27 9.73 41.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 26.9 t-20 -104.5 134.28 19.75 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.8 -179.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.73 -110.17 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.824 2.35 . . . . 0.0 113.489 -177.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -97.67 -11.59 23.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.139 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -107.89 101.29 10.58 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.874 -176.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -98.94 -18.98 17.56 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.17 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -59.42 -47.61 84.82 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.411 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.9 p90 -72.06 -36.54 69.61 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.238 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.9 94.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.367 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -68.9 -38.77 79.82 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.885 -178.608 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -68.61 -36.55 78.82 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.04 176.089 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 66.8 mmtt -64.71 -33.34 75.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -68.92 -39.94 79.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.328 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -62.59 -47.8 82.2 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.108 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 7.1 pt-20 -65.87 -44.08 86.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.314 -176.625 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.667 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.7 p -65.58 -38.34 82.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.237 -0.585 . . . . 0.0 111.144 -177.477 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.85 82.19 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.903 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -74.0 -41.31 62.08 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.157 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.614 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -74.44 -35.95 63.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.922 -173.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.623 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -69.18 -42.72 75.47 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 176.638 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -57.95 -48.49 79.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.809 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.41 HG11 ' HA ' ' A' ' 52' ' ' ALA . 11.2 p -69.68 -41.64 80.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.598 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.68 HD23 ' HD3' ' A' ' 62' ' ' ARG . 2.9 tm? -73.91 -30.27 62.49 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.1 t -78.96 -17.57 55.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.153 -0.342 . . . . 0.0 110.861 -176.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.48 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 22.0 t70 -112.44 127.53 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.321 0.581 . . . . 0.0 110.504 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.547 ' HB2' ' HZ2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.41 -36.36 82.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.293 -175.33 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.51 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 73.6 t60 -68.37 -40.56 81.41 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.48 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 74.9 mmtt -61.17 -43.18 99.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.549 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.68 ' HD3' HD23 ' A' ' 56' ' ' LEU . 50.6 mtm105 -60.45 -45.08 94.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 178.301 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -60.9 -39.91 91.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.622 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.46 HG12 ' O ' ' A' ' 60' ' ' HIS . 33.8 mm -65.2 -44.26 95.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.078 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -61.59 -38.49 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.061 0.458 . . . . 0.0 110.516 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -64.99 -46.36 81.79 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.421 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.405 ' HD3' HD12 ' A' ' 64' ' ' ILE . 11.7 ptm180 -81.4 -28.44 34.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -176.714 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -93.49 -8.61 41.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.86 0.362 . . . . 0.0 110.799 -174.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -52.42 -50.53 47.24 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.703 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.07 -28.24 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.181 -0.509 . . . . 0.0 112.111 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.056 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.704 ' HA ' ' HE2' ' A' ' 65' ' ' TYR . . . -110.62 -34.76 6.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.409 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.1 m 59.16 29.37 18.91 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 121.343 0.592 . . . . 0.0 110.307 -173.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.812 ' HA ' HG12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -69.17 -38.01 78.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.293 -172.888 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.603 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.6 p90 -61.28 -33.27 73.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.147 173.449 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 4.5 mt-10 -75.37 -44.21 46.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.626 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.812 HG12 ' HA ' ' A' ' 4' ' ' TYR . 11.0 pt -70.5 -40.33 77.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -169.238 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.493 HD12 HG23 ' A' ' 19' ' ' ILE . 18.5 mt -93.34 -75.61 0.49 Allowed 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.319 -176.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.0 t70 171.58 -24.48 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 O-C-N 124.338 1.024 . . . . 0.0 110.779 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.603 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 31.4 m -118.61 150.88 49.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.593 -170.147 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -91.36 -179.78 1.44 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.534 2.823 . . . . 0.0 113.067 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.644 ' HA ' ' HE2' ' A' ' 4' ' ' TYR . 32.9 mtm180 -60.14 -15.16 21.4 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.459 -167.324 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -82.18 -6.82 59.48 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.06 135.39 35.82 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.103 0.478 . . . . 0.0 111.044 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 t -81.05 166.11 21.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.619 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.31 -43.75 64.68 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -172.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.451 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 1.3 m-20 -65.74 -33.45 75.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.534 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -67.68 -40.49 84.41 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.715 HD13 ' HH ' ' A' ' 4' ' ' TYR . 1.8 mp -60.68 -41.52 88.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.056 173.351 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.451 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 36.4 ttmt -55.74 -43.71 76.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.18 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -69.37 -35.66 76.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.225 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.489 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -60.45 -42.51 96.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.082 0.468 . . . . 0.0 110.472 177.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.911 ' HD1' HG23 ' A' ' 49' ' ' VAL . 3.4 t80 -63.22 -43.23 98.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.864 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.438 ' O ' HD12 ' A' ' 28' ' ' LEU . 70.9 mtp180 -68.31 -44.17 76.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.489 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 10.1 ptm180 -66.1 -33.52 75.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.04 0.448 . . . . 0.0 110.492 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.6 ' HD3' ' HB ' ' A' ' 49' ' ' VAL . 35.7 tttp -70.42 -43.59 69.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.556 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.48 -47.74 81.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.566 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.438 HD12 ' O ' ' A' ' 24' ' ' ARG . 7.4 mp -62.88 -37.59 87.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.336 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.73 -30.17 71.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.975 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.574 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 59.1 m95 -108.46 17.56 21.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 111.479 -178.102 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -83.19 152.32 64.7 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 171.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -54.9 -27.04 51.63 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.845 3.03 . . . . 0.0 112.862 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.51 -34.79 77.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.36 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.14 -31.88 8.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.022 0.439 . . . . 0.0 111.554 -177.591 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -103.9 135.0 19.42 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.12 -119.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.82 2.347 . . . . 0.0 114.589 -169.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -94.29 -7.65 41.3 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -167.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -93.55 101.64 13.82 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -94.52 -26.88 16.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -173.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.13 -46.51 88.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.273 -175.227 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.46 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 18.9 m-85 -72.96 -38.5 66.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.574 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -62.47 -46.15 89.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.421 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 3.1 pt-20 -70.29 -36.04 74.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.354 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.612 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 12.1 mmmt -58.83 -44.64 90.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.875 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.46 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 30.6 mmtp -66.84 -35.35 79.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.075 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -64.16 -40.25 95.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.296 174.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -67.01 -36.52 82.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.99 176.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.612 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 43.4 mm-40 -63.29 -44.69 94.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.014 0.435 . . . . 0.0 110.417 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.911 HG23 ' HD1' ' A' ' 23' ' ' TYR . 3.2 p -72.73 -37.38 55.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.92 177.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.62 -44.94 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.475 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.16 -42.85 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.05 0.453 . . . . 0.0 111.244 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.525 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -71.47 -34.84 70.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.392 0.615 . . . . 0.0 111.552 -176.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.425 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 28.0 t80 -71.58 -34.7 70.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.932 175.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.03 -49.99 75.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.119 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.802 HG22 ' HG3' ' A' ' 61' ' ' LYS . 7.1 p -65.18 -38.52 82.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.338 . . . . 0.0 110.737 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.54 HD11 ' O ' ' A' ' 56' ' ' LEU . 0.8 OUTLIER -73.73 -18.49 60.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.983 0.421 . . . . 0.0 110.96 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 t -78.27 -22.81 47.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.01 -174.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -112.15 124.56 52.7 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.446 ' HD3' ' H ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.15 -35.84 81.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.297 0.57 . . . . 0.0 110.98 -172.86 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.602 ' O ' HG12 ' A' ' 64' ' ' ILE . 48.9 t60 -70.6 -41.4 72.36 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.126 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.802 ' HG3' HG22 ' A' ' 55' ' ' VAL . 3.7 tppp? -61.87 -36.35 81.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.523 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.4 ' HG2' HD23 ' A' ' 56' ' ' LEU . 23.0 mtp180 -58.86 -46.55 87.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.516 179.439 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.558 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.1 pt-20 -71.71 -33.96 69.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.693 0.282 . . . . 0.0 110.343 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 60' ' ' HIS . 48.9 mm -64.51 -44.68 96.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 CA-C-O 121.129 0.49 . . . . 0.0 109.704 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.704 ' HE2' ' HA ' ' A' ' 2' ' ' ALA . 60.1 t80 -58.63 -41.99 87.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.874 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -72.85 -45.91 55.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.797 -175.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 -86.72 -29.31 22.5 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -174.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -94.68 -7.23 41.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.126 0.489 . . . . 0.0 110.201 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 -37.45 94.55 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -60.7 -26.41 67.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.923 -1.138 . . . . 0.0 111.701 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.764 179.462 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.945 0.403 . . . . 0.0 109.945 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.488 ' C ' ' H ' ' A' ' 4' ' ' TYR . . . -83.61 74.85 10.09 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.411 ' HA ' ' CZ ' ' A' ' 5' ' ' TYR . 3.1 m -73.72 33.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.065 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.613 ' O ' HG13 ' A' ' 7' ' ' ILE . 60.2 m-85 -68.31 -24.58 64.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.694 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.573 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 4.3 p90 -57.63 -32.73 67.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.766 173.315 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.508 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 9.1 mm-40 -73.59 -44.32 57.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.021 0.438 . . . . 0.0 110.929 178.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.613 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.3 pp -71.11 -31.02 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.751 -174.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.412 HD22 HG23 ' A' ' 19' ' ' ILE . 61.1 tp -97.66 -79.94 0.46 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.601 -179.153 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.611 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 25.1 t70 174.73 -40.56 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.41 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 30.1 m -121.72 157.49 56.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.527 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.573 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 5.9 Cg_exo -78.34 159.82 29.35 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.388 2.725 . . . . 0.0 112.486 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -62.44 -22.55 66.29 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.646 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -65.71 -17.97 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.277 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.98 146.46 43.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.819 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.8 t -59.61 156.67 13.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -178.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.07 -42.35 63.11 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -174.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -62.89 -34.57 77.68 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.71 -44.13 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.621 0.248 . . . . 0.0 111.112 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.412 HG23 HD22 ' A' ' 8' ' ' LEU . 2.0 mp -60.2 -44.61 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.338 0.589 . . . . 0.0 109.979 175.681 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -65.43 -36.98 85.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.471 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.821 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.076 176.761 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.611 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.54 -44.21 96.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.892 0.377 . . . . 0.0 110.756 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.734 ' HD1' HG23 ' A' ' 49' ' ' VAL . 1.1 t80 -57.98 -49.39 76.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.686 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 25.9 mtp180 -68.0 -32.68 73.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.706 0.288 . . . . 0.0 111.176 -178.602 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 22.3 ttm180 -63.75 -46.62 84.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.304 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -70.96 -40.85 71.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.067 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.27 -37.2 66.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.422 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.412 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -70.5 -36.86 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.473 178.606 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 13.1 mm-40 -63.31 -35.63 81.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.079 0.466 . . . . 0.0 110.616 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 29.4 m95 -105.75 19.0 21.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.651 -177.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.521 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.2 t-80 -72.3 141.41 83.34 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.521 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 13.4 Cg_endo -55.2 -31.06 74.37 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.844 3.029 . . . . 0.0 114.205 -168.036 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -70.61 -34.48 72.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.025 0.44 . . . . 0.0 111.183 177.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -90.26 -0.74 57.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.326 0.584 . . . . 0.0 110.08 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.459 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 26.8 t-20 -103.2 141.83 23.3 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.54 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -74.89 -120.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.427 2.085 . . . . 0.0 112.695 -177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -100.15 -8.23 23.9 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -176.731 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -104.9 100.94 10.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.972 0.415 . . . . 0.0 110.467 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.454 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -96.88 -17.87 19.88 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.268 -177.622 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.434 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 6.6 tp10 -53.4 -46.93 69.91 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.451 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -73.47 -36.73 65.89 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.459 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.17 -45.78 91.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.742 0.306 . . . . 0.0 111.231 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.445 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 9.4 pt-20 -69.59 -37.64 77.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.496 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.631 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -60.56 -45.77 92.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.162 178.537 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -66.03 -39.28 90.06 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.281 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -59.04 -40.33 84.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.213 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.13 -40.97 82.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.716 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.631 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 13.4 mm-40 -63.64 -44.59 93.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.999 -176.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.734 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.3 p -72.26 -37.76 59.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.791 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.94 92.59 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.41 -38.85 68.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.981 0.42 . . . . 0.0 110.871 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.38 -36.95 71.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.666 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.402 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.77 -36.98 67.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.08 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.23 -47.49 85.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.553 HG21 ' HB3' ' A' ' 61' ' ' LYS . 9.0 p -69.78 -38.12 75.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.091 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.466 HD22 ' O ' ' A' ' 56' ' ' LEU . 8.2 tt -71.59 -29.34 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -173.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -78.86 -19.38 52.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.669 0.271 . . . . 0.0 111.514 -174.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.474 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 21.7 t70 -113.13 133.38 55.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.292 0.568 . . . . 0.0 111.415 -176.487 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.479 ' HE3' ' HB2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.96 -34.47 78.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.853 -177.769 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.425 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.3 m80 -68.96 -44.43 72.97 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.176 0.512 . . . . 0.0 110.124 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.553 ' HB3' HG21 ' A' ' 55' ' ' VAL . 14.1 mmmm -65.01 -37.94 89.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.566 -176.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 27.7 mtm180 -66.16 -45.58 80.44 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 -177.201 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.408 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 9.7 pt-20 -71.76 -32.71 67.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.893 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.589 HD12 ' HD3' ' A' ' 67' ' ' ARG . 30.1 mm -66.84 -36.01 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.441 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -63.18 -36.2 82.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.44 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -45.7 79.93 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.582 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.589 ' HD3' HD12 ' A' ' 64' ' ' ILE . 10.2 ptm180 -83.93 -47.13 11.35 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -94.65 -9.61 34.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.91 0.386 . . . . 0.0 111.239 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.59 -53.06 4.48 Favored Glycine 0 CA--C 1.507 -0.425 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.982 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 mmm-85 -61.18 -27.04 68.13 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.05 -0.575 . . . . 0.0 112.197 -177.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.614 -0.708 . . . . 0.0 110.609 -179.02 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.9 mtm . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.066 0.46 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.418 ' C ' ' H ' ' A' ' 4' ' ' TYR . . . -157.4 103.19 1.95 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.41 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' SER . . . . . 0.461 ' O ' HG22 ' A' ' 7' ' ' ILE . 15.8 m -81.47 31.36 0.34 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.083 0.468 . . . . 0.0 110.944 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.693 ' OH ' HG12 ' A' ' 19' ' ' ILE . 1.0 OUTLIER -63.59 -37.37 87.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.087 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -67.5 -31.92 72.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.389 . . . . 0.0 110.677 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -73.23 -44.35 59.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.392 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.571 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.5 pp -70.43 -39.12 76.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.315 -175.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.498 HD23 ' HB1' ' A' ' 22' ' ' ALA . 38.0 tp -101.47 -82.27 0.47 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.12 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.9 t70 174.08 -29.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.029 -175.747 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -119.56 155.44 54.35 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.098 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.19 -177.63 3.97 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.032 2.488 . . . . 0.0 112.656 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.7 mtp180 -78.64 -9.37 59.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.846 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -74.3 -9.0 58.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.558 ' HB2' ' HB3' ' A' ' 18' ' ' ASP . . . -84.55 144.22 28.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.638 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.4 m -80.8 167.67 19.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.749 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.91 -43.11 65.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.679 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.42 -35.86 78.73 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.166 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.558 ' HB3' ' HB2' ' A' ' 14' ' ' ALA . 41.1 t0 -70.22 -43.76 69.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.306 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.693 HG12 ' OH ' ' A' ' 4' ' ' TYR . 1.2 mp -61.12 -41.76 90.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.743 175.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.832 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 58.0 mttm -55.6 -45.9 77.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.001 173.587 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -35.01 79.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.502 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.658 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -66.36 -43.9 84.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.832 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 3.4 p90 -66.43 -37.15 84.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.966 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.416 HH11 ' HD2' ' A' ' 24' ' ' ARG . 26.5 mtp180 -57.2 -44.81 83.99 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 123.153 0.283 . . . . 0.0 111.164 177.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.658 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 7.2 ptm180 -67.3 -34.43 77.37 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.103 0.478 . . . . 0.0 110.427 -177.702 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -67.54 -38.42 84.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.121 175.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.518 ' HA ' ' CE2' ' A' ' 30' ' ' TRP . . . -55.49 -40.64 71.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.306 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.404 HD13 ' HA ' ' A' ' 28' ' ' LEU . 1.7 mm? -66.6 -35.9 81.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.055 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -62.39 -34.78 77.39 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.518 ' CE2' ' HA ' ' A' ' 27' ' ' ALA . 47.4 p-90 -105.14 12.27 32.22 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 110.745 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.611 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 16.4 t-80 -72.19 142.21 84.53 Favored Pre-proline 0 C--N 1.321 -0.662 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 15.0 Cg_endo -54.44 -27.95 51.9 Favored 'Trans proline' 0 N--CA 1.482 0.797 0 C-N-CA 124.111 3.207 . . . . 0.0 114.616 -168.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -70.65 -29.84 66.29 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.902 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -91.69 -46.15 8.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.883 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.417 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 67.2 t30 -103.42 129.12 26.05 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.417 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 41.6 Cg_endo -91.1 -101.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.577 2.185 . . . . 0.0 115.103 -167.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -86.32 -8.56 57.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.821 0.343 . . . . 0.0 111.84 -168.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -94.85 99.9 11.88 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.828 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.494 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 0.9 OUTLIER -93.91 -18.38 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.964 178.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.55 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 8.5 tp10 -54.95 -46.12 74.96 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.121 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -72.14 -40.77 67.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.76 177.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.465 ' HA ' ' HB2' ' A' ' 30' ' ' TRP . . . -62.38 -45.97 90.73 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.225 -174.556 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.494 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.0 pt-20 -71.71 -37.22 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.995 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.55 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -65.96 -40.29 91.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.671 -177.938 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.489 ' O ' HG13 ' A' ' 49' ' ' VAL . 67.1 mmtt -69.28 -35.31 75.91 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.258 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -59.24 -42.65 91.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.949 173.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -66.77 -42.84 85.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.763 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.28 -44.45 95.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.244 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.557 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 8.3 p -72.59 -37.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.304 -178.064 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.523 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -61.4 -45.94 92.24 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.14 -176.636 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.406 ' O ' HG13 ' A' ' 55' ' ' VAL . 13.2 pt-20 -72.15 -43.23 64.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.021 0.439 . . . . 0.0 110.897 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.571 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -72.5 -38.95 68.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.86 -173.435 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.557 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -70.99 -42.6 69.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.523 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.8 OUTLIER -58.64 -49.73 76.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.483 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.642 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.3 p -70.06 -45.17 77.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-N 116.343 -0.389 . . . . 0.0 112.003 -178.267 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.753 HD21 ' HD3' ' A' ' 62' ' ' ARG . 12.4 mt -74.87 -29.69 61.09 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.5 t -80.09 -18.36 50.17 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.682 -177.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -111.91 127.45 55.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.634 ' N ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -69.19 -28.85 66.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.235 -173.466 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 49.6 m80 -68.63 -43.17 76.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.46 178.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.642 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.8 OUTLIER -70.25 -38.26 75.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.481 -178.922 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.753 ' HD3' HD21 ' A' ' 56' ' ' LEU . 12.2 mmm180 -58.15 -38.19 76.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.968 175.483 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.446 ' O ' ' HD2' ' A' ' 67' ' ' ARG . 6.1 mm-40 -66.19 -42.91 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.383 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 41.5 mm -64.01 -44.29 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.773 -177.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . 0.401 ' HB2' HG23 ' A' ' 55' ' ' VAL . 52.0 t80 -67.08 -37.37 83.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.881 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -73.17 -46.3 51.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.024 0.44 . . . . 0.0 111.443 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.446 ' HD2' ' O ' ' A' ' 63' ' ' GLU . 4.1 ptm85 -81.28 -44.09 18.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.619 -173.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -94.89 -10.46 31.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -70.07 -49.56 33.41 Favored Glycine 0 CA--C 1.505 -0.57 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.649 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -65.2 -25.37 67.68 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.958 -0.621 . . . . 0.0 111.943 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 28.1 mm-40 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.042 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.72 -63.66 0.38 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.675 0.79 . . . . 0.0 111.624 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.8 m 65.83 -4.04 0.67 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.466 0.707 . . . . 0.0 112.632 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.569 ' O ' HG13 ' A' ' 7' ' ' ILE . 45.9 m-85 -68.37 -28.88 67.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.948 0.404 . . . . 0.0 111.114 -176.98 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -64.22 -32.46 74.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.006 0.432 . . . . 0.0 110.771 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.03 -43.84 51.32 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.313 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.569 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.4 pp -70.36 -37.83 72.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.34 -174.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -100.72 -84.62 0.43 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.8 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.853 ' HB3' ' HB3' ' A' ' 22' ' ' ALA . 31.8 t70 176.35 -33.24 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.41 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.3 m -119.99 156.77 54.16 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.145 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.41 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 86.6 Cg_endo -78.54 -177.49 3.93 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.92 2.413 . . . . 0.0 112.888 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -77.53 -21.78 52.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.041 0.448 . . . . 0.0 111.126 -178.004 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -78.76 1.79 21.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.582 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.442 ' HB2' HD13 ' A' ' 19' ' ' ILE . . . -84.57 145.79 27.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 0.0 110.737 177.925 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.1 t -70.51 160.84 31.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.79 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.43 -42.7 64.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 0.0 111.667 -174.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -61.62 -35.66 78.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.545 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -63.27 -45.77 89.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.442 HD13 ' HB2' ' A' ' 14' ' ' ALA . 2.0 mp -62.38 -45.63 98.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.339 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.71 -39.91 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.773 0.32 . . . . 0.0 111.0 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.753 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.91 -42.15 81.58 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 177.289 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.853 ' HB3' ' HB3' ' A' ' 9' ' ' ASP . . . -60.78 -43.48 98.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.958 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.74 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -62.16 -47.87 82.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.777 178.704 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.538 ' HG3' ' CE2' ' A' ' 23' ' ' TYR . 88.8 mtt180 -69.29 -39.32 78.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.405 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 5.0 ptp180 -63.0 -38.17 90.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.632 178.095 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.465 ' HG3' ' HZ3' ' A' ' 30' ' ' TRP . 65.6 tttm -69.41 -40.75 77.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.221 0.534 . . . . 0.0 110.042 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.57 94.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.597 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.44 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.4 mp -71.56 -37.2 71.11 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -67.84 -28.59 67.69 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.618 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 12.5 m-90 -109.01 18.62 20.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.551 0.691 . . . . 0.0 110.698 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.504 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 54.6 t60 -74.06 142.87 79.84 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 172.639 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.76 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 11.3 Cg_endo -54.29 -28.92 55.07 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.504 2.802 . . . . 0.0 113.343 -173.679 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.45 -23.76 63.71 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.251 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -122.51 18.23 10.47 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.76 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -102.27 145.83 31.22 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.536 -175.701 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -81.79 -110.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 122.997 2.464 . . . . 0.0 113.421 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -93.48 -11.68 31.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.774 0.321 . . . . 0.0 111.524 -174.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.467 ' HB2' ' HB2' ' A' ' 41' ' ' PHE . 7.3 p30 -106.92 114.71 28.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.95 0.405 . . . . 0.0 111.036 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 5.5 mptt -103.86 -32.3 9.36 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.576 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -66.93 -43.99 81.81 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.496 177.96 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.467 ' HB2' ' HB2' ' A' ' 38' ' ' ASN . 75.0 m-85 -72.33 -37.39 68.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.095 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.618 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -61.46 -45.41 94.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.795 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -67.65 -35.77 79.51 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.146 176.742 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.595 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -61.93 -40.87 97.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.467 177.709 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -63.87 -34.6 78.31 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.193 0.52 . . . . 0.0 109.666 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . 0.401 ' O ' HG12 ' A' ' 49' ' ' VAL . 85.6 t80 -66.77 -41.8 87.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.042 175.017 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -57.68 -44.9 86.12 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.595 ' HG3' ' O ' ' A' ' 44' ' ' LYS . 50.8 mt-10 -63.01 -45.6 91.59 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.054 0.454 . . . . 0.0 110.277 -177.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.74 HG23 ' HD1' ' A' ' 23' ' ' TYR . 9.7 p -70.88 -37.18 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.126 -172.599 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.9 -45.56 88.78 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.041 179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -72.66 -41.81 65.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.066 0.46 . . . . 0.0 110.747 -179.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.556 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -73.14 -43.66 61.25 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.996 -174.341 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.48 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -66.97 -35.38 79.84 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.837 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -60.73 -50.78 72.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.607 179.762 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.794 ' HA ' ' HD2' ' A' ' 61' ' ' LYS . 10.0 p -71.35 -39.55 72.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.582 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.428 ' O ' HD21 ' A' ' 56' ' ' LEU . 9.4 tt -72.83 -28.9 62.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -173.314 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -78.0 -15.33 59.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.409 -175.139 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.543 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 30.5 t70 -112.15 121.46 45.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.429 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -61.67 -34.33 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.549 -175.351 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -69.76 -44.5 70.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.776 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.794 ' HD2' ' HA ' ' A' ' 55' ' ' VAL . 22.8 ttmm -71.01 -43.37 68.1 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.915 -174.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.543 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 27.1 ptt180 -67.57 -38.57 84.3 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.511 -177.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.418 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 8.9 pt-20 -72.68 -36.39 67.88 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.498 177.6 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.91 -39.36 85.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.61 -35.32 80.63 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.007 0.432 . . . . 0.0 110.33 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -72.8 -48.9 34.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.896 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.23 -42.13 11.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -95.04 -10.67 30.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 0.0 110.359 -170.382 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.14 -46.58 93.69 Favored Glycine 0 CA--C 1.505 -0.54 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.695 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -61.9 -26.67 68.31 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.451 -0.874 . . . . 0.0 111.903 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.419 -177.566 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -131.75 144.2 50.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.331 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.0 m -63.53 -8.19 8.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.983 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.749 ' HA ' HG12 ' A' ' 7' ' ' ILE . 34.1 m-85 -63.09 -28.06 69.82 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.296 0.57 . . . . 0.0 109.823 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -61.26 -37.62 83.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.205 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -74.0 -42.6 60.13 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.132 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.835 HD11 ' HB2' ' A' ' 52' ' ' ALA . 11.2 pt -70.98 -41.99 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.697 -172.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.542 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 15.6 mt -102.83 -74.82 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.015 0.436 . . . . 0.0 110.312 178.004 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.4 t70 172.07 -31.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.804 -173.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 25.1 m -120.98 150.62 53.59 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.831 179.699 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 7.6 Cg_endo -87.5 -172.2 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.247 2.632 . . . . 0.0 112.968 -176.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.489 ' HB3' ' CD2' ' A' ' 4' ' ' TYR . 15.7 ptm180 -68.31 -21.29 64.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.717 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p -67.94 -15.96 63.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.979 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.05 144.21 29.23 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.084 176.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 p -72.97 148.17 44.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.136 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.2 -31.08 41.14 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -167.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 2.9 m-20 -65.71 -35.27 80.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.37 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.39 -37.33 82.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.487 0.66 . . . . 0.0 109.433 176.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.434 HG23 ' CD1' ' A' ' 8' ' ' LEU . 1.7 mp -60.31 -46.78 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.2 175.637 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 17' ' ' ASP . 21.1 pttm -66.01 -33.86 76.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.004 0.431 . . . . 0.0 110.359 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.442 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 7.8 tptm -66.71 -41.63 87.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.377 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.589 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -61.68 -40.16 93.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.476 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.483 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -57.42 -42.18 81.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.762 175.848 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -64.92 -38.18 90.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.991 0.424 . . . . 0.0 110.899 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -67.3 -44.38 79.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.589 ' HG3' ' O ' ' A' ' 22' ' ' ALA . 26.1 mtpp -62.83 -38.86 92.43 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.065 0.459 . . . . 0.0 109.804 176.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.17 -46.16 75.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.881 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.6 -36.93 73.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.038 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -62.07 -39.82 93.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.535 -176.274 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.491 ' O ' ' HB3' ' A' ' 42' ' ' ALA . 96.6 m95 -109.02 18.03 21.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.87 0.367 . . . . 0.0 111.87 -176.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.61 145.66 71.72 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 170.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.487 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 14.8 Cg_endo -55.27 -28.42 62.13 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.02 3.147 . . . . 0.0 113.695 -170.381 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.48 -29.26 69.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.958 0.408 . . . . 0.0 111.023 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -108.44 14.83 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.087 0.47 . . . . 0.0 110.329 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.487 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 28.6 t-20 -115.33 134.46 22.58 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -89.04 -107.81 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.838 2.359 . . . . 0.0 113.61 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.73 -10.22 23.45 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . 0.482 ' HB3' ' HD1' ' A' ' 41' ' ' PHE . 10.0 m120 -106.39 100.6 10.12 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.058 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -91.44 -28.66 17.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.315 -0.402 . . . . 0.0 109.993 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -56.4 -43.94 79.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.565 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.482 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 83.8 m-85 -66.99 -37.86 84.99 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.691 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.491 ' HB3' ' O ' ' A' ' 30' ' ' TRP . . . -66.46 -44.95 81.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.347 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -69.36 -37.96 77.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.594 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.731 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 9.2 mtpm? -65.28 -46.1 81.81 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.719 176.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -64.61 -34.51 78.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.472 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.74 -40.86 98.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.661 174.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.411 ' HE3' ' OE2' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -70.1 -33.94 72.49 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.435 176.202 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.731 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 17.3 mm-40 -63.8 -45.54 89.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 110.616 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.483 HG23 ' HD1' ' A' ' 23' ' ' TYR . 6.5 p -71.08 -36.13 61.78 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.181 179.275 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.67 -46.57 81.05 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.181 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.405 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 11.5 pt-20 -73.3 -43.54 60.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.109 0.481 . . . . 0.0 110.807 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.835 ' HB2' HD11 ' A' ' 7' ' ' ILE . . . -70.3 -38.92 75.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.718 -173.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -72.37 -37.82 68.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.308 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.16 -50.35 73.54 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.18 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.9 p -65.81 -42.74 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.404 HD21 HD12 ' A' ' 8' ' ' LEU . 40.0 tp -74.35 -29.24 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.874 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.6 t -79.74 -14.73 58.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.82 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.639 ' HB3' ' HD3' ' A' ' 61' ' ' LYS . 38.5 m-20 -109.68 121.37 45.06 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.42 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -66.03 -34.98 79.32 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.825 -173.154 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.545 ' HA ' ' OE2' ' A' ' 63' ' ' GLU . 64.8 t60 -71.93 -38.13 69.9 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.337 177.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.639 ' HD3' ' HB3' ' A' ' 58' ' ' ASP . 1.8 mptm? -68.69 -45.06 72.65 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.777 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -68.03 -33.91 75.49 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.457 -178.119 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.545 ' OE2' ' HA ' ' A' ' 60' ' ' HIS . 15.8 pt-20 -69.65 -37.0 76.59 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.552 -0.459 . . . . 0.0 109.835 177.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 24.0 mm -66.31 -44.09 91.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.062 175.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.61 -34.43 76.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.804 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.19 -47.13 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.6 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -89.4 -34.37 16.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -105.08 -4.1 22.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.221 0.534 . . . . 0.0 110.909 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.64 63.69 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.315 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -59.97 -37.57 79.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.005 -0.598 . . . . 0.0 111.848 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.627 -0.702 . . . . 0.0 111.088 -176.349 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.52 109.32 6.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.652 0.263 . . . . 0.0 110.676 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.3 m -64.24 -16.39 61.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.17 0.509 . . . . 0.0 110.698 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.662 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.9 m-85 -66.42 -27.97 68.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.468 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -63.99 -37.17 86.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.391 0.615 . . . . 0.0 109.553 175.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -73.14 -44.17 60.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.207 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.906 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.7 pp -71.75 -37.8 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.446 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . 0.418 ' O ' ' HB3' ' A' ' 9' ' ' ASP . 34.9 tp -99.89 -87.81 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.504 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.418 ' HB3' ' O ' ' A' ' 8' ' ' LEU . 5.7 p-10 170.65 -11.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.212 0.605 . . . . 0.0 110.376 177.786 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.449 HG22 ' HA ' ' A' ' 19' ' ' ILE . 19.8 m -119.95 151.67 52.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.502 174.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -90.31 -168.18 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.217 2.611 . . . . 0.0 113.639 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -78.53 -31.48 47.57 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 m -70.58 -7.29 42.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.995 0.426 . . . . 0.0 111.29 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.502 ' HB3' HD13 ' A' ' 19' ' ' ILE . . . -76.3 144.06 40.47 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.036 176.198 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.7 t -74.94 154.93 37.93 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.229 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.24 -41.12 62.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.92 0.391 . . . . 0.0 111.434 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.42 -34.41 77.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.578 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -68.85 -41.13 78.86 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.502 HD13 ' HB3' ' A' ' 14' ' ' ALA . 2.0 mp -60.66 -41.88 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.314 0.578 . . . . 0.0 109.692 172.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -59.15 -42.66 91.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.011 177.772 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -42.77 86.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.607 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.33 -41.47 93.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.567 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . 0.764 ' HD1' HG23 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -64.22 -42.02 96.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.921 175.085 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -65.03 -43.53 92.09 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.485 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 25.3 ptt180 -69.86 -39.21 76.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -64.54 -39.82 94.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.24 -39.26 92.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.122 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -40.29 90.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.066 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 26.9 mm-40 -62.85 -37.32 86.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.261 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . 0.409 ' CE3' ' HB3' ' A' ' 45' ' ' LYS . 13.2 m0 -110.18 19.42 18.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.086 0.47 . . . . 0.0 111.269 -176.739 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.71 141.2 82.07 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.58 -29.11 68.47 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.382 2.722 . . . . 0.0 112.362 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.22 -33.31 75.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.77 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -115.83 18.9 15.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.734 -173.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.456 ' OD1' ' HD2' ' A' ' 39' ' ' LYS . 26.8 t-20 -115.51 135.16 22.57 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.851 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 58.8 Cg_endo -88.12 -106.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.924 2.416 . . . . 0.0 114.05 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -97.06 -8.41 30.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -171.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -103.25 99.41 9.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.456 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 12.4 mmmm -101.99 -30.0 11.46 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.227 -171.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -61.33 -45.53 94.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.002 -174.273 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -72.04 -36.4 69.62 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.168 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.58 -44.3 96.66 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.727 0.298 . . . . 0.0 111.007 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.55 -42.3 74.77 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.081 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -70.16 -37.71 75.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.324 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.46 ' O ' HG13 ' A' ' 49' ' ' VAL . 64.4 mmtt -68.26 -35.18 77.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.657 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -62.84 -39.71 95.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.694 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -65.53 -44.01 88.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.388 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -66.34 -42.62 87.86 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.77 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.764 HG23 ' HD1' ' A' ' 23' ' ' TYR . 7.0 p -66.11 -37.29 79.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.876 178.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.496 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -62.19 -45.44 93.37 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 111.599 -178.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.56 -37.65 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.071 0.462 . . . . 0.0 110.41 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.906 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -75.4 -39.29 59.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.085 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.496 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -72.12 -35.34 69.11 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 179.01 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -61.63 -48.11 82.34 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.577 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.615 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 14.3 p -65.63 -38.8 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.955 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.408 HD22 ' HB3' ' A' ' 4' ' ' TYR . 52.5 tp -72.67 -28.19 62.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 t -78.57 -20.09 51.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.989 0.423 . . . . 0.0 110.328 -176.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.72 ' HB2' ' HB2' ' A' ' 61' ' ' LYS . 73.1 m-20 -111.77 121.85 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.595 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.501 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 3.4 mppt? -67.2 -34.29 77.19 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.48 ' O ' HG12 ' A' ' 64' ' ' ILE . 81.9 m-70 -69.73 -32.86 71.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.076 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.72 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.2 tppp? -71.41 -41.68 69.28 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.615 ' HG3' ' O ' ' A' ' 55' ' ' VAL . 25.7 mtp180 -61.98 -42.6 99.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.576 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 13.1 pt-20 -67.55 -33.12 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.202 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.48 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.6 mm -65.2 -44.11 95.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 175.012 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -59.15 -37.48 77.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.259 0.552 . . . . 0.0 109.876 175.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -72.27 -47.25 51.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.144 -176.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -88.49 -37.51 15.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.478 ' HA ' ' HG2' ' A' ' 71' ' ' GLU . 32.3 t80 -95.44 -9.49 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.877 0.37 . . . . 0.0 110.543 -173.825 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.69 -48.01 84.69 Favored Glycine 0 CA--C 1.51 -0.271 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.635 175.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.41 -25.98 68.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.473 -0.864 . . . . 0.0 111.465 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.478 ' HG2' ' HA ' ' A' ' 68' ' ' TYR . 18.4 mm-40 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.07 -176.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.3 mmm . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.358 0.123 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.414 ' HB3' ' CE2' ' A' ' 5' ' ' TYR . . . -65.32 -45.88 82.53 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.662 0.268 . . . . 0.0 111.327 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.7 t 68.59 -14.09 0.29 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 172.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' TYR . . . . . 0.567 ' CD1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -62.69 -38.08 88.97 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 122.002 -0.436 . . . . 0.0 111.32 -176.956 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' TYR . . . . . 0.434 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 3.6 p90 -61.3 -32.14 71.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.034 174.781 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -73.71 -45.09 54.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.916 0.388 . . . . 0.0 111.077 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ILE . . . . . 0.727 HD13 ' HB2' ' A' ' 52' ' ' ALA . 2.6 pp -71.72 -30.99 40.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.813 -176.403 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.0 tp -99.66 -87.03 0.37 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.424 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.729 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 23.9 t70 177.85 -33.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.038 0.447 . . . . 0.0 110.853 -174.437 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.02 156.52 56.77 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.417 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.434 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 80.3 Cg_endo -92.99 174.48 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.487 2.791 . . . . 0.0 112.844 178.726 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.746 ' HD3' ' H ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -57.34 -22.67 43.9 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 114.711 -1.132 . . . . 0.0 113.842 -168.974 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 t -58.64 -24.12 60.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.925 0.393 . . . . 0.0 111.113 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.847 ' HB3' ' HB3' ' A' ' 18' ' ' ASP . . . -78.82 143.78 35.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.144 0.497 . . . . 0.0 111.719 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.7 t -78.54 164.66 24.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.658 173.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.14 -34.44 44.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.168 0.509 . . . . 0.0 111.451 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.99 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.813 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ASP . . . . . 0.847 ' HB3' ' HB3' ' A' ' 14' ' ' ALA . 11.3 t70 -69.34 -36.61 77.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.808 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.534 HD13 ' HH ' ' A' ' 4' ' ' TYR . 1.5 mp -59.12 -43.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.995 172.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -65.13 -37.86 88.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.043 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.594 ' HA ' ' HE ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -70.24 -35.28 73.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.357 175.413 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.729 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -59.82 -42.09 92.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.26 0.552 . . . . 0.0 110.736 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.66 -40.85 96.13 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.408 173.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.594 ' HE ' ' HA ' ' A' ' 21' ' ' LYS . 9.9 mtm180 -67.19 -45.57 76.51 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.897 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . 0.437 ' O ' ' HG3' ' A' ' 29' ' ' GLN . 1.6 ptm180 -64.81 -32.63 74.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.865 0.364 . . . . 0.0 110.336 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LYS . . . . . 0.506 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 0.6 OUTLIER -71.31 -38.89 71.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.126 0.489 . . . . 0.0 110.139 176.979 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.19 -37.09 66.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.74 171.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.1 mp -67.86 -35.72 79.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.423 175.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.506 ' OE1' ' HA ' ' A' ' 26' ' ' LYS . 50.9 mt-30 -62.24 -34.23 76.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.056 0.455 . . . . 0.0 110.295 177.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -106.39 18.72 21.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.504 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . 0.556 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.42 152.05 94.07 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.445 -178.439 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 11.2 Cg_endo -54.92 -29.36 63.54 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.231 2.62 . . . . 0.0 112.791 -178.157 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.712 ' HB2' ' HD2' ' A' ' 34' ' ' LYS . 1.3 m-20 -60.92 -34.78 75.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.338 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.712 ' HD2' ' HB2' ' A' ' 33' ' ' ASP . 0.1 OUTLIER -108.11 18.06 21.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.719 -178.256 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASN . . . . . 0.611 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.4 t-20 -116.18 136.27 22.98 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.097 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 53.1 Cg_endo -85.73 -121.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.947 2.432 . . . . 0.0 112.723 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . 0.413 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 43.7 m-20 -97.44 -9.17 27.77 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.894 0.378 . . . . 0.0 111.137 -177.098 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.34 101.95 11.46 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 51.4 mttm -99.42 -21.04 16.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -57.27 -42.89 82.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -67.35 -35.6 79.72 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.829 0.347 . . . . 0.0 110.309 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.55 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 24.3 mt-10 -69.44 -42.24 75.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 109.825 176.097 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.572 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 46.8 tptt -57.67 -46.7 83.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.705 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 65.1 mmtt -66.0 -35.49 80.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.29 -39.9 89.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.789 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.432 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 95.2 mttt -66.7 -44.21 82.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.222 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.572 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 16.5 mm-40 -65.11 -41.5 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 p -71.04 -37.3 66.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.603 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.15 92.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.607 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . 0.458 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 9.6 pt-20 -71.36 -41.6 69.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.173 0.511 . . . . 0.0 110.372 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ALA . . . . . 0.727 ' HB2' HD13 ' A' ' 7' ' ' ILE . . . -68.65 -42.7 77.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.534 -174.642 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -38.31 71.35 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -69.89 -43.45 71.75 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.511 -175.339 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . 0.57 HG21 ' HD2' ' A' ' 62' ' ' ARG . 11.8 p -68.27 -37.23 77.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.588 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 0.636 HD11 ' O ' ' A' ' 56' ' ' LEU . 1.9 tm? -72.17 -26.0 61.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.907 0.384 . . . . 0.0 110.327 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 t -76.32 -19.85 57.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.076 -174.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.621 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 23.1 t70 -112.36 121.63 45.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.42 0.629 . . . . 0.0 109.916 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.903 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.68 -37.22 85.88 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.99 -174.441 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 47.0 t60 -68.91 -39.54 79.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.287 -179.208 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . 0.621 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 41.5 mmtm -60.96 -36.15 78.64 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.219 177.029 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ARG . . . . . 0.57 ' HD2' HG21 ' A' ' 55' ' ' VAL . 9.8 mmm180 -63.81 -46.39 85.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.203 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLU . . . . . 0.471 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.2 pt-20 -65.43 -38.85 91.12 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.718 -0.393 . . . . 0.0 109.983 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ILE . . . . . 0.497 HD12 ' HD3' ' A' ' 67' ' ' ARG . 44.5 mm -67.8 -44.09 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.551 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -60.93 -42.79 98.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.259 -176.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.29 -42.06 62.85 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . 0.497 ' HD3' HD12 ' A' ' 64' ' ' ILE . 8.0 ptm180 -72.17 -30.9 65.44 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 111.452 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.423 ' HB3' ' O ' ' A' ' 64' ' ' ILE . 0.1 OUTLIER -103.96 -6.13 21.54 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.421 0.629 . . . . 0.0 110.943 -174.446 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.47 -48.99 67.79 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.472 -0.785 . . . . 0.0 113.619 -178.377 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -58.4 -46.23 86.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -176.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.394 -0.813 . . . . 0.0 110.513 -179.521 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.638 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 30.2 t80 -59.13 -35.34 73.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -177.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -56.82 -42.61 79.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.139 0.495 . . . . 0.0 110.21 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -74.63 -45.09 47.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.928 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.901 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.2 pp -72.8 -40.88 61.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -167.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.67 -106.08 0.25 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.322 -169.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.461 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 26.6 t70 -140.53 -35.71 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.84 -171.315 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.542 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 31.6 m -129.79 162.08 55.62 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.693 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.542 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.8 Cg_endo -62.11 160.78 28.84 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.589 2.859 . . . . 0.0 113.108 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.6 106.74 11.85 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.909 0.861 . . . . 0.0 109.182 175.679 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -176.65 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 145.59 47.35 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.086 173.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -68.08 165.74 17.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.19 -177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.577 ' HA ' HD13 ' A' ' 19' ' ' ILE . . . -51.88 -30.11 22.66 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.074 0.464 . . . . 0.0 111.843 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.5 -44.39 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -68.84 -34.99 76.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.212 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' CZ ' ' A' ' 4' ' ' TYR . 1.9 mp -57.54 -47.8 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.673 176.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -65.83 -38.29 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.056 0.455 . . . . 0.0 110.126 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 1.2 tmtt? -69.68 -35.42 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.733 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -63.85 -35.86 82.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 110.462 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.682 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -64.01 -48.04 77.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.188 173.456 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 71.9 mtp180 -64.68 -43.25 94.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.357 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 8.9 ptp85 -65.21 -39.96 93.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.719 0.295 . . . . 0.0 110.439 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HA ' ' HB3' ' A' ' 29' ' ' GLN . 24.1 ttmm -71.73 -35.81 70.27 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.573 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.87 -44.96 74.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.189 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 10.7 mp -71.48 -34.81 70.51 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.782 175.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 33.5 tt0 -61.66 -36.82 81.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.393 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.558 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 95.3 m95 -111.85 19.35 18.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.342 0.592 . . . . 0.0 110.82 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.612 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 27.7 t60 -72.14 145.04 88.07 Favored Pre-proline 0 C--N 1.322 -0.61 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.612 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.4 Cg_endo -54.21 -28.73 53.36 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.866 3.044 . . . . 0.0 113.633 -174.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.38 -25.17 65.83 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.123 0.487 . . . . 0.0 110.134 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.72 2.59 21.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.117 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.602 HD21 ' HG3' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -104.04 140.29 20.93 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 120.939 0.399 . . . . 0.0 110.216 -176.108 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 62.6 Cg_endo -87.34 -119.52 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.047 2.498 . . . . 0.0 112.757 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.409 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 4.0 m-20 -86.91 -8.05 57.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.114 0.483 . . . . 0.0 111.157 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.569 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 55.1 m-80 -102.47 102.95 13.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.242 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.602 ' HG3' HD21 ' A' ' 35' ' ' ASN . 0.1 OUTLIER -97.77 -31.07 12.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.949 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -61.75 -44.88 96.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.205 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 82.6 m-85 -66.79 -37.43 84.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.448 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -68.15 -45.99 72.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.029 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.3 pt-20 -70.3 -36.22 74.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.546 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 8.5 ttmm -59.53 -44.44 93.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 120.864 0.364 . . . . 0.0 110.147 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' HG12 ' A' ' 49' ' ' VAL . 62.9 mmtt -68.12 -39.64 82.72 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -62.44 -41.59 98.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.377 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 51.3 mtmt -68.34 -44.11 76.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.749 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 12.7 pt-20 -72.27 -36.28 68.97 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.682 HG21 ' HA ' ' A' ' 23' ' ' TYR . 7.8 p -67.21 -38.38 80.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.085 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.84 -44.46 96.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 11.5 pt-20 -72.7 -40.66 66.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.967 0.413 . . . . 0.0 111.083 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.901 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.04 -40.03 68.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.454 -175.011 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -69.28 -34.23 74.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 175.362 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.46 -50.26 74.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.901 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.606 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 3.2 m -67.93 -40.98 84.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.5 HD23 HG12 ' A' ' 19' ' ' ILE . 31.1 tp -73.1 -28.83 62.5 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.169 -0.612 . . . . 0.0 112.06 -175.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.9 t -77.98 -22.63 49.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.784 0.326 . . . . 0.0 110.228 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.826 ' HB3' ' HG3' ' A' ' 61' ' ' LYS . 11.7 t70 -112.41 121.67 45.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.082 0.468 . . . . 0.0 109.747 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.594 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 3.0 mptp? -66.56 -34.99 79.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.005 -170.175 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.514 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.5 t-80 -69.68 -42.16 74.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.517 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.826 ' HG3' ' HB3' ' A' ' 58' ' ' ASP . 4.6 mtpt -60.49 -33.76 73.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.623 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 14.9 mtm105 -60.63 -46.67 89.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.03 0.443 . . . . 0.0 110.654 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 14.8 pt-20 -71.84 -30.12 65.13 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.592 -176.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.823 HD13 ' HD3' ' A' ' 67' ' ' ARG . 47.8 mm -63.65 -38.02 81.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -65.24 -39.92 93.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.277 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -72.83 -45.73 56.8 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.823 ' HD3' HD13 ' A' ' 64' ' ' ILE . 9.0 ptm180 -71.61 -41.71 68.56 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 122.33 -0.231 . . . . 0.0 111.388 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.01 -0.46 57.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.512 0.673 . . . . 0.0 109.773 -174.216 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.59 -48.76 8.66 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 166.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -65.75 -45.51 82.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.431 -0.885 . . . . 0.0 111.585 175.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.953 179.146 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.503 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -61.32 -36.85 81.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.862 -178.964 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.551 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 2.1 p90 -57.35 -39.3 75.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.153 175.448 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.551 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 8.0 mm-40 -73.88 -44.36 55.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.463 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.52 HD11 HD11 ' A' ' 56' ' ' LEU . 2.3 pp -71.15 -31.73 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.715 -173.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.7 tp -97.39 -78.37 0.48 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.801 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 177.56 -44.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.251 0.548 . . . . 0.0 110.222 -175.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 27.5 m -120.5 156.14 55.92 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.642 -170.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.475 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 87.1 Cg_endo -81.74 174.66 10.13 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.201 2.6 . . . . 0.0 112.042 176.876 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' HG2' ' H ' ' A' ' 12' ' ' ARG . 7.3 ptm85 -78.05 -8.92 58.82 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.392 -174.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 m -69.35 -13.85 62.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.082 0.467 . . . . 0.0 110.776 176.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.98 144.27 28.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.6 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 m -72.74 163.59 27.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.738 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.28 -40.14 61.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -173.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.15 -34.52 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.358 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 21.1 t70 -69.66 -40.03 76.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.81 -40.93 88.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.825 172.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.887 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 26.7 ttpp -57.59 -43.33 84.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.556 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.781 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.2 mmpt? -63.54 -35.98 82.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.537 174.811 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.55 -47.88 77.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.887 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 12.4 p90 -70.09 -36.93 75.26 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.894 -0.722 . . . . 0.0 109.849 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.8 mmt180 -57.52 -45.7 84.69 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.893 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 6.3 ptp180 -67.07 -39.18 86.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.797 0.332 . . . . 0.0 110.514 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -64.76 -38.27 90.42 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.92 -36.27 80.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.074 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 6.4 mp -69.68 -36.21 75.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.404 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.23 -37.4 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.769 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -108.22 20.27 18.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.808 0.337 . . . . 0.0 111.064 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.2 t-80 -72.02 140.67 83.38 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.343 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.526 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 9.3 Cg_endo -53.07 -37.28 79.02 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.731 2.287 . . . . 0.0 113.327 -167.028 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -67.88 -26.49 66.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 111.162 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 12.9 mmtp -107.34 15.12 25.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.498 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -107.76 134.33 20.1 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.365 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 95.7 Cg_endo -81.26 -120.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 122.951 2.434 . . . . 0.0 113.251 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.42 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 20.9 m-20 -97.04 -9.33 28.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 111.613 -173.208 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.451 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 91.2 m-20 -100.69 101.62 12.54 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.578 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.5 OUTLIER -93.53 -29.63 15.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.314 -174.581 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -54.43 -44.84 72.77 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.549 0.531 . . . . 0.0 110.979 -174.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 89.9 m-85 -62.61 -43.11 99.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.03 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.84 96.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.016 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 15.7 mt-10 -69.56 -44.14 71.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.024 0.44 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -64.98 -41.48 95.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.287 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 66.5 mmtt -71.69 -34.57 69.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.661 0.267 . . . . 0.0 110.333 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -60.76 -39.27 88.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.085 0.469 . . . . 0.0 109.751 174.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.94 -45.77 84.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.488 174.718 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -63.74 -43.93 95.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.467 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 23' ' ' TYR . 11.2 p -67.35 -36.72 77.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.782 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.695 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . . . -63.87 -45.77 87.93 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.91 0.386 . . . . 0.0 111.74 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -70.69 -36.8 73.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.544 0.688 . . . . 0.0 109.979 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -73.97 -45.94 47.06 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.662 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.695 ' CD2' ' HA ' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.13 -34.77 78.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.998 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -51.24 68.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.322 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' A' ' 52' ' ' ALA . 14.6 p -71.84 -39.09 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 52' ' ' ALA . 46.6 mt -68.47 -24.29 64.68 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -172.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.8 t -78.3 -23.11 47.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.907 0.385 . . . . 0.0 110.36 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -114.33 121.58 44.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.0 111.027 -177.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.28 -36.25 83.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.691 -178.064 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.443 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 32.2 m-70 -69.14 -41.86 76.76 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.853 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 61' ' ' LYS . 26.7 ttmt -63.09 -33.78 76.18 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.07 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -62.13 -37.14 84.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.821 174.226 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 41.5 mt-10 -63.38 -43.08 98.62 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.114 0.483 . . . . 0.0 110.175 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.14 -44.93 95.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -66.19 -35.36 80.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.19 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.8 -47.38 69.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -82.67 -41.28 19.58 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -93.19 9.91 34.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.561 0.696 . . . . 0.0 110.112 -171.666 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -87.03 -47.59 4.68 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 169.886 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -66.7 -42.36 86.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.366 -0.917 . . . . 0.0 110.659 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 C--O 1.246 0.921 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 120.98 0.419 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.2 m-85 -68.5 -33.71 74.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.112 0.482 . . . . 0.0 110.458 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.79 -35.07 78.65 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.518 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -74.55 -43.97 53.23 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.138 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.669 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -69.51 -40.96 80.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -174.067 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 7' ' ' ILE . 32.6 tp -102.58 -104.02 0.28 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.011 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.553 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 7.2 m-20 -158.48 -22.65 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.125 -177.223 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.4 m -118.48 158.52 46.74 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.647 -176.586 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.618 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.3 Cg_endo -59.3 -81.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.079 2.519 . . . . 0.0 114.118 -172.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' HD11 ' A' ' 56' ' ' LEU . 37.8 ptt180 -171.32 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -177.393 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.5 t -97.25 27.41 4.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.304 0.573 . . . . 0.0 110.455 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.44 145.92 30.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.497 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.5 m -55.37 128.58 34.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ALA . . . . . 0.599 ' O ' ' HG2' ' A' ' 20' ' ' LYS . . . -53.23 -33.75 54.22 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -170.644 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.75 -34.8 77.95 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.878 0.371 . . . . 0.0 110.753 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.82 -35.81 77.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.754 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.802 HG21 ' HB2' ' A' ' 57' ' ' SER . 2.4 mp -59.72 -42.68 89.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.733 170.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 16' ' ' ALA . 71.0 mmtt -61.22 -37.91 84.72 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.562 175.384 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.604 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.63 -47.44 78.54 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.26 176.749 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 9' ' ' ASP . . . -60.63 -39.57 88.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.136 0.494 . . . . 0.0 110.466 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.528 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -67.57 -50.0 60.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.486 176.684 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtt85 -68.36 -37.78 80.79 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 25' ' ' ARG . 8.4 ttt-85 -62.12 -44.44 96.64 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.973 0.416 . . . . 0.0 110.742 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.635 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.2 ttmm -66.46 -42.34 87.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 110.078 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.99 84.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.293 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -66.86 -37.05 83.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.538 -177.98 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -64.12 -34.82 78.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 0.0 110.925 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 99.1 m95 -106.45 19.3 20.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.288 0.566 . . . . 0.0 110.546 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.512 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.27 152.2 94.38 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.356 -178.427 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.1 Cg_endo -54.81 -30.09 66.01 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.492 2.128 . . . . 0.0 112.074 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.8 -24.38 62.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.899 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.43 -3.42 12.42 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -173.645 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 29.9 p30 -103.54 140.25 20.88 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.262 0.554 . . . . 0.0 110.458 -176.12 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 55.5 Cg_endo -92.19 -104.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.155 2.57 . . . . 0.0 112.85 -177.863 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -98.12 -7.21 30.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.84 0.352 . . . . 0.0 111.854 -176.445 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -94.34 100.91 12.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 0.0 110.182 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -101.63 -29.54 11.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.52 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.85 -43.6 90.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.227 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -71.02 -37.48 72.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.627 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 30' ' ' TRP . . . -63.5 -43.87 95.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.949 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.577 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 10.2 pt-20 -69.55 -38.94 77.68 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.323 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -59.76 -47.8 84.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.684 0.278 . . . . 0.0 110.949 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 67.1 mmtt -65.09 -35.22 80.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.687 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -67.08 -40.73 87.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.475 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 88.2 mttt -68.36 -46.52 69.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 11.9 pt-20 -67.29 -37.49 83.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.376 -175.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.635 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 14.7 p -71.8 -37.72 63.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.334 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -44.37 94.59 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.336 -178.725 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.96 -40.92 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.19 0.519 . . . . 0.0 110.603 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.669 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.2 -38.93 60.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.083 -175.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.518 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.5 -35.75 68.23 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.45 -45.55 90.35 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.399 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.745 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 11.1 p -70.23 -41.07 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.738 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.474 HD11 ' HA ' ' A' ' 12' ' ' ARG . 58.4 tp -74.31 -30.93 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' SER . . . . . 0.802 ' HB2' HG21 ' A' ' 19' ' ' ILE . 32.1 t -81.72 -21.17 38.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.731 0.301 . . . . 0.0 110.98 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 20.2 t70 -111.83 124.46 52.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 -174.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -66.93 -32.19 73.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.505 ' O ' HG12 ' A' ' 64' ' ' ILE . 43.0 m-70 -68.39 -41.89 79.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 177.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.745 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 5.9 mptp? -61.51 -36.71 81.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.568 174.349 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 46.8 mmm-85 -59.94 -40.8 90.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.059 0.457 . . . . 0.0 109.842 174.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 44.1 mt-10 -65.22 -40.17 93.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.996 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 60' ' ' HIS . 42.4 mm -64.43 -44.45 97.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.776 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.05 -37.33 87.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.914 0.388 . . . . 0.0 110.501 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.08 -45.09 95.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -88.73 -48.05 7.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -94.64 -9.74 34.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.861 0.362 . . . . 0.0 111.248 -170.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.16 -44.63 97.46 Favored Glycine 0 CA--C 1.506 -0.479 0 N-CA-C 111.198 -0.761 . . . . 0.0 111.198 175.189 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -66.7 -34.28 77.5 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.25 -0.975 . . . . 0.0 111.559 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.957 -177.569 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 121.411 0.625 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.579 ' HA ' HG13 ' A' ' 7' ' ' ILE . 98.7 m-85 -68.79 -23.86 64.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.559 176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -56.59 -33.01 65.8 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.0 -44.37 61.11 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.411 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.851 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.8 -39.18 67.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.826 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.491 ' N ' HD12 ' A' ' 7' ' ' ILE . 38.4 tp -100.59 -90.56 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 171.1 -16.04 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.513 0.725 . . . . 0.0 109.924 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.98 152.46 56.48 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.975 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -87.59 165.49 7.76 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.907 2.405 . . . . 0.0 112.524 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.808 ' HB3' HD11 ' A' ' 56' ' ' LEU . 11.0 ptm180 -70.15 -3.91 18.98 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.472 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 t -56.02 -33.5 64.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.261 172.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -76.34 146.03 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.423 177.736 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.8 p -63.76 155.81 29.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.231 177.579 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.84 64.11 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -170.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.481 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 21.7 m-20 -62.7 -34.42 77.1 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.979 0.418 . . . . 0.0 111.346 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.401 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 5.2 t70 -62.41 -41.37 98.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.865 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.447 HG23 HD22 ' A' ' 8' ' ' LEU . 1.9 mp -62.61 -39.19 83.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.6 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 90.9 mttt -58.24 -41.29 83.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.251 177.585 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -68.88 -36.01 77.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.509 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.34 -35.96 82.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.23 0.538 . . . . 0.0 110.075 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.698 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -65.67 -43.6 88.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.835 174.56 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -68.22 -38.51 81.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.764 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.418 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 4.0 ptm180 -69.37 -36.7 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.902 0.382 . . . . 0.0 110.488 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 21.2 ttmm -70.92 -42.48 69.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 121.163 0.506 . . . . 0.0 109.769 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.38 -45.82 84.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.946 176.326 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.71 -37.32 83.72 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.936 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -65.63 -31.19 72.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.337 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.555 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 98.6 m95 -105.4 13.37 30.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.069 0.461 . . . . 0.0 111.462 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -82.04 147.75 58.58 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.54 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.56 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 12.2 Cg_endo -54.25 -29.4 56.97 Favored 'Trans proline' 0 N--CA 1.477 0.501 0 C-N-CA 124.27 3.313 . . . . 0.0 113.625 -167.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -64.2 -30.59 71.64 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.105 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -111.56 7.55 20.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.56 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 27.0 t-20 -107.98 140.06 21.28 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.467 -176.811 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 91.4 Cg_endo -78.02 -117.76 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.863 2.375 . . . . 0.0 112.753 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.413 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 2.5 m-20 -97.11 -7.03 33.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.591 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 16.8 m120 -103.59 99.02 8.82 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.206 -173.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -93.06 -25.77 17.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.867 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 7.8 tm-20 -60.85 -44.08 97.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.666 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.591 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 54.7 m-85 -71.97 -37.83 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 175.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.87 -46.21 88.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.641 0.258 . . . . 0.0 111.184 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -69.32 -35.63 76.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 5.1 tttp -58.77 -48.43 81.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.629 177.072 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.434 ' O ' HG12 ' A' ' 49' ' ' VAL . 63.7 mmtt -72.01 -34.99 69.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.911 -178.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.98 -40.19 92.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.243 0.544 . . . . 0.0 109.689 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -67.37 -45.87 75.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.467 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.79 -43.3 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.635 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.698 HG22 ' HD1' ' A' ' 23' ' ' TYR . 12.0 p -67.89 -37.4 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.909 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.73 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.775 0.322 . . . . 0.0 111.263 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.08 -36.85 69.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.078 0.466 . . . . 0.0 110.525 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.851 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.62 -38.53 58.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.091 -173.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -36.08 72.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -65.03 -47.08 78.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.612 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.616 ' HA ' ' CB ' ' A' ' 61' ' ' LYS . 11.8 p -64.68 -38.71 83.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.37 . . . . 0.0 111.145 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 12' ' ' ARG . 48.1 tp -74.08 -29.15 61.72 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.7 t -84.19 -19.55 33.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.495 0.188 . . . . 0.0 111.205 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 23.3 t70 -112.36 129.99 56.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.383 0.611 . . . . 0.0 111.56 -174.606 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.723 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.69 -36.06 81.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.153 -175.425 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.416 ' O ' HD13 ' A' ' 64' ' ' ILE . 35.5 m170 -69.75 -41.89 74.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.128 0.49 . . . . 0.0 110.227 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.809 ' HA ' ' HE2' ' A' ' 61' ' ' LYS . 10.5 mmpt? -61.15 -37.76 84.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.603 176.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 89.0 mtt180 -61.77 -47.22 86.17 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.758 0.313 . . . . 0.0 111.427 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -71.39 -35.8 71.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.611 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.6 mp -65.11 -39.19 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.62 -38.02 83.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.401 . . . . 0.0 110.629 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -73.08 -47.72 42.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.453 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 64' ' ' ILE . 8.6 ptm180 -77.01 -30.93 56.06 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -173.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -94.85 -10.14 32.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.286 0.565 . . . . 0.0 110.053 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.64 -47.27 10.25 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.312 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -62.82 -27.64 69.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.003 -0.598 . . . . 0.0 111.832 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.464 -0.779 . . . . 0.0 111.376 -176.526 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.9 p . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.261 0.553 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.518 ' O ' HG13 ' A' ' 7' ' ' ILE . 57.2 m-85 -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.794 176.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.38 -32.7 73.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.427 176.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -73.36 -44.03 59.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.07 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.5 pp -70.22 -40.54 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.38 -176.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 20.2 tp -102.29 -93.08 0.31 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.049 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.412 ' H ' ' H ' ' A' ' 10' ' ' VAL . 4.5 p30 174.27 3.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.021 0.826 . . . . 0.0 110.771 173.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.453 HG22 HD23 ' A' ' 8' ' ' LEU . 17.0 m -121.11 154.39 58.26 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-O 120.643 0.258 . . . . 0.0 110.985 176.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.41 161.7 43.74 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.181 2.587 . . . . 0.0 112.619 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.534 ' HD3' ' N ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -68.6 -20.4 64.5 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.501 -175.083 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . 0.534 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 21.0 m -77.32 -2.51 35.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.328 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.725 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -74.22 143.49 45.11 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.338 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -86.04 173.01 10.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.993 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.23 -39.7 60.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -64.84 -41.16 95.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.338 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.725 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 3.3 m-20 -62.01 -44.12 97.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.248 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.639 HG22 ' HD2' ' A' ' 53' ' ' TYR . 1.9 mp -63.92 -38.67 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.456 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -36.08 80.82 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.798 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.1 mmpt? -64.07 -46.62 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.122 175.65 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.405 ' HB2' HG13 ' A' ' 10' ' ' VAL . . . -63.74 -37.51 87.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 110.591 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.621 ' HA ' HG21 ' A' ' 49' ' ' VAL . 2.7 t80 -63.02 -46.7 86.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.792 175.155 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -67.55 -37.2 82.33 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -176.409 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 25' ' ' ARG . 5.4 ptp180 -67.89 -40.76 83.48 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.177 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.937 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.6 ttmm -70.23 -42.5 72.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.371 0.605 . . . . 0.0 109.56 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.55 -44.7 85.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.399 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.5 -46.25 90.79 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.391 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.09 -31.54 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.139 -177.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.716 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 89.1 m95 -106.09 18.89 21.37 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.077 0.465 . . . . 0.0 111.323 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m170 -83.65 143.75 44.46 Favored Pre-proline 0 C--N 1.32 -0.675 0 O-C-N 122.069 -0.395 . . . . 0.0 110.165 173.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.0 -25.92 56.29 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.671 2.914 . . . . 0.0 111.941 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -59.73 -33.63 71.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.21 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -113.68 -29.88 6.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.77 ' ND2' ' HD2' ' A' ' 36' ' ' PRO . 3.3 t-20 -102.44 132.5 21.32 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.77 ' HD2' ' ND2' ' A' ' 35' ' ' ASN . 74.2 Cg_endo -73.61 -115.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.982 2.454 . . . . 0.0 115.699 -167.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.44 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 6.7 m-20 -85.91 -7.2 58.85 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -165.287 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -101.62 98.41 8.71 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.38 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -103.92 -23.13 13.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.767 -176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 21.5 tt0 -66.26 -41.02 90.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.299 0.571 . . . . 0.0 110.601 -178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.34 -37.46 83.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.83 177.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.716 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.66 -44.39 81.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.029 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 12.9 pt-20 -67.34 -36.46 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.75 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -60.05 -40.85 90.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.715 0.293 . . . . 0.0 110.706 174.331 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 68.2 mmtt -71.84 -35.25 69.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.799 0.333 . . . . 0.0 110.565 177.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.44 -39.33 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.718 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -65.31 -41.72 93.77 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.431 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.28 -43.2 98.6 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.473 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.937 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 6.7 p -70.42 -38.84 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.524 178.132 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HA ' ' HD1' ' A' ' 53' ' ' TYR . . . -61.43 -45.07 95.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.554 0.216 . . . . 0.0 111.58 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.0 pt-20 -71.91 -43.63 65.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.017 0.437 . . . . 0.0 111.032 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.63 67.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.43 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.639 ' HD2' HG22 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -70.63 -33.66 71.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -60.68 -42.31 96.84 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.535 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.775 HG13 ' HG3' ' A' ' 61' ' ' LYS . 64.3 t -69.04 -44.81 80.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.001 0.429 . . . . 0.0 110.566 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.561 ' HG ' HG12 ' A' ' 19' ' ' ILE . 40.3 tp -72.25 -17.48 61.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.323 -175.664 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.8 m -82.83 -18.39 40.61 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 122.043 -0.41 . . . . 0.0 111.922 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -109.01 123.4 49.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.202 0.525 . . . . 0.0 111.482 -175.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -61.08 -38.01 84.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.653 -177.734 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.421 ' O ' HD13 ' A' ' 64' ' ' ILE . 80.6 t60 -65.12 -40.51 94.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.775 ' HG3' HG13 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -70.28 -33.63 71.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.382 177.698 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.74 -47.46 83.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.097 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -71.32 -34.96 71.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.863 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.421 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.5 mp -65.04 -42.5 94.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -65.62 -36.73 84.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.978 0.418 . . . . 0.0 110.225 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.19 -47.84 78.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.661 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.686 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 10.8 ptm180 -88.58 -48.86 7.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -94.3 -10.56 32.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.92 0.391 . . . . 0.0 111.176 -168.426 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.4 -49.32 6.29 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.474 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -67.42 -25.52 65.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.673 -0.763 . . . . 0.0 112.751 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.686 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 75.4 mm-40 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.929 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.807 ' HA ' HG12 ' A' ' 7' ' ' ILE . 66.8 m-85 -68.44 -26.12 65.36 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.67 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.0 -39.31 81.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.667 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -73.51 -44.21 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.847 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.831 HD12 ' HB1' ' A' ' 52' ' ' ALA . 12.4 pt -71.81 -42.31 69.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -172.488 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.511 ' N ' HG13 ' A' ' 7' ' ' ILE . 15.6 mt -103.85 -75.3 0.62 Allowed 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 120.966 0.412 . . . . 0.0 109.937 176.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 168.95 -30.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.514 -174.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.0 m -120.66 154.12 56.98 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.9 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.76 -178.63 4.54 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.994 2.463 . . . . 0.0 112.616 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.85 -17.58 61.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.99 0.424 . . . . 0.0 111.346 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -23.42 66.7 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.562 175.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 145.84 44.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.914 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.2 m -67.63 159.78 29.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.978 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.04 -36.27 60.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.179 0.514 . . . . 0.0 111.223 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -61.5 -40.28 94.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.812 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -62.2 -44.61 96.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.657 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.85 -45.73 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.748 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.5 ttmm -60.83 -40.85 94.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.773 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HD2' ' HA ' ' A' ' 21' ' ' LYS . 9.6 mmmm -70.33 -35.56 73.69 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.92 -41.58 96.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.268 0.556 . . . . 0.0 109.642 173.375 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.54 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -65.47 -44.11 88.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.012 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -61.88 -41.16 97.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.748 0.309 . . . . 0.0 111.629 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -67.48 -44.12 79.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.503 . . . . 0.0 110.952 175.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CG ' ' HB ' ' A' ' 49' ' ' VAL . 3.6 tppp? -60.35 -38.59 84.29 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.311 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.707 ' HA ' ' NE1' ' A' ' 30' ' ' TRP . . . -60.62 -42.13 96.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.995 175.192 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.4 -35.4 73.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.65 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 24.2 mm-40 -60.38 -33.37 72.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.275 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.707 ' NE1' ' HA ' ' A' ' 27' ' ' ALA . 64.1 p-90 -106.46 6.42 30.24 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.626 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.1 m170 -74.2 146.99 85.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.563 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 17.0 Cg_endo -55.67 -28.1 64.3 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.758 2.972 . . . . 0.0 112.687 -176.885 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.82 -24.38 63.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.124 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -119.16 -10.87 9.69 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.446 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.563 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -104.44 133.86 19.98 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 92.1 Cg_endo -96.56 -112.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.394 2.73 . . . . 0.0 113.096 -177.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -85.23 -6.75 59.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.61 0.719 . . . . 0.0 110.065 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.769 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 80.9 m-20 -90.66 103.09 15.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.731 -174.599 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -98.2 -29.32 13.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.091 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 34.1 tt0 -59.71 -44.69 93.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.133 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.769 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 93.4 m-85 -65.04 -37.65 88.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.913 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.25 -44.7 94.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.188 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.04 -37.95 75.72 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.748 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 55.7 mtpt -63.75 -46.29 85.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.616 0.246 . . . . 0.0 110.99 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.617 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 30.1 mmtp -66.55 -34.68 78.44 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.32 -50.89 71.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.077 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HB2' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -69.08 -43.15 75.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.103 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 9.1 pt-20 -64.83 -37.31 87.19 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.971 -175.291 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.54 HG22 ' HD1' ' A' ' 23' ' ' TYR . 13.1 p -72.42 -38.94 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 C-N-CA 120.139 -0.625 . . . . 0.0 110.869 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.33 -45.41 91.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 11.1 pt-20 -72.02 -43.16 65.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.058 -179.17 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.831 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -75.07 -42.48 56.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.177 -173.272 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 4.1 t80 -70.89 -35.57 72.39 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.215 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.96 -50.46 68.54 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.01 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.543 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.6 p -62.55 -41.3 91.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -175.668 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 tp -75.18 -28.96 60.24 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.1 m -85.9 -19.44 30.53 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.777 0.322 . . . . 0.0 111.043 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -102.51 124.22 47.68 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.593 0.711 . . . . 0.0 110.767 -177.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.677 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 8.0 mptt -68.86 -31.43 70.37 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.154 -175.175 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.61 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 87.9 m-70 -70.44 -43.83 69.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.187 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -65.08 -34.42 78.38 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 175.127 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 mmm180 -59.25 -41.66 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.625 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.61 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 41.7 mt-10 -60.59 -43.37 97.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.827 0.346 . . . . 0.0 110.799 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.36 -44.93 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -66.18 -35.25 79.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.234 0.54 . . . . 0.0 110.413 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.89 -45.79 87.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.611 -177.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -88.46 -37.56 15.71 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -101.0 9.87 41.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 0.0 111.495 -171.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.77 -56.43 4.15 Favored Glycine 0 CA--C 1.508 -0.369 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.53 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -66.62 -36.63 83.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.154 -0.523 . . . . 0.0 112.064 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.793 -0.623 . . . . 0.0 111.012 -176.734 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.3 p . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.498 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 38.2 m-85 -68.82 -27.05 65.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.176 0.513 . . . . 0.0 110.971 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.563 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 1.3 p90 -66.78 -32.7 74.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.489 173.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.404 ' HG3' ' CD1' ' A' ' 5' ' ' TYR . 37.4 mt-10 -74.25 -43.83 55.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.124 177.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.498 ' CG1' ' HA ' ' A' ' 4' ' ' TYR . 2.5 pp -71.6 -33.21 48.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.781 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG23 ' A' ' 19' ' ' ILE . 54.0 tp -99.36 -79.69 0.48 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.966 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 176.35 -41.02 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.16 -175.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 m -122.99 151.55 61.52 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.197 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.563 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 27.4 Cg_endo -64.37 151.39 85.69 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.137 2.558 . . . . 0.0 112.166 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -73.38 -15.03 61.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.21 -172.014 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.9 m -62.2 -18.88 62.32 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.937 174.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -73.49 145.94 45.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.8 t -66.12 161.7 21.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.458 -177.002 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.5 50.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.202 0.525 . . . . 0.0 110.665 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -60.72 -41.89 96.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.411 178.201 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 10.5 m-20 -68.28 -41.24 81.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.497 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.616 HG22 ' HD1' ' A' ' 53' ' ' TYR . 1.7 mp -60.77 -42.85 93.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.932 174.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -62.0 -40.86 97.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.409 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.5 mmpt? -63.08 -40.97 99.24 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.4 176.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -60.45 -46.13 91.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.096 0.474 . . . . 0.0 110.258 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.476 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -61.94 -48.59 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.8 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.95 78.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.461 HH11 ' HD3' ' A' ' 25' ' ' ARG . 18.6 ttt-85 -60.58 -44.06 96.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.997 177.676 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.65 ' HD2' HG21 ' A' ' 49' ' ' VAL . 58.4 mttm -67.72 -37.19 81.9 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.267 0.556 . . . . 0.0 109.922 177.357 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.48 75.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.708 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 3.5 mm? -71.89 -35.78 69.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.01 0.433 . . . . 0.0 111.047 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.01 -38.78 89.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.847 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -109.61 20.69 17.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.348 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.48 ' HB2' ' HA ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -69.29 145.69 96.07 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.382 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 10.5 Cg_endo -53.52 -34.34 72.0 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 122.355 2.037 . . . . 0.0 113.098 -168.528 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.91 -24.17 63.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.072 0.463 . . . . 0.0 110.969 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -113.87 7.89 17.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.99 145.77 31.19 Favored Pre-proline 0 C--O 1.234 0.286 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.058 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 84.0 Cg_endo -81.44 -120.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.941 2.428 . . . . 0.0 112.949 -174.012 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.439 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 5.2 m-20 -97.11 -8.15 30.91 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.866 0.365 . . . . 0.0 111.218 -176.191 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -98.61 100.63 11.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.951 0.405 . . . . 0.0 110.26 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 13.8 mptt -92.61 -30.67 15.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.314 175.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 15.5 tp10 -60.84 -43.94 97.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.897 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -72.32 -38.29 68.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.586 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.32 90.83 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 11.2 pt-20 -71.22 -37.76 72.04 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.907 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 20.6 tptp -61.12 -45.96 92.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.549 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.405 ' O ' HG12 ' A' ' 49' ' ' VAL . 31.9 mmtp -65.96 -38.14 87.82 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.995 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -62.15 -40.08 94.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.653 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.4 mmtt -66.74 -41.77 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.856 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.32 -44.12 92.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.001 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 ' HD2' ' A' ' 26' ' ' LYS . 7.3 p -72.03 -38.28 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.007 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.08 95.6 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.213 -0.195 . . . . 0.0 111.37 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 10.7 pt-20 -72.05 -40.27 68.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.0 110.728 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 51' ' ' GLU . . . -72.39 -38.96 68.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.633 -174.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.84 -40.48 72.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -62.12 -49.88 74.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.012 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.02 -38.08 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 111.306 -177.49 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.0 tp -72.99 -26.26 61.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.772 0.32 . . . . 0.0 111.418 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -82.06 -18.8 41.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.674 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.483 ' HB3' ' HB2' ' A' ' 61' ' ' LYS . 17.6 t70 -110.35 122.2 47.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 0.0 110.318 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -66.35 -34.33 77.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.427 -174.833 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 33.6 t60 -71.97 -40.51 68.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.13 -34.32 77.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.972 177.339 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 66' ' ' ASP . 0.8 OUTLIER -60.15 -42.56 95.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.788 173.805 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.507 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 38.4 mt-10 -61.05 -44.71 96.98 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.176 0.512 . . . . 0.0 110.107 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 48.7 mm -68.82 -46.09 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.804 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -64.5 -35.91 82.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -177.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -70.32 -45.66 65.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.088 -174.241 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.582 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 9.1 ptm180 -85.61 -27.48 25.43 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.742 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.4 9.93 29.66 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.806 0.812 . . . . 0.0 109.792 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.82 -50.4 3.11 Favored Glycine 0 N--CA 1.442 -0.904 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.17 172.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -65.16 -46.92 78.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.755 -0.723 . . . . 0.0 111.812 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 9.5 pt-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.413 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.9 t . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.581 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 85.1 m-85 -62.54 -29.86 70.87 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.86 0.362 . . . . 0.0 111.52 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -34.78 78.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.914 0.388 . . . . 0.0 110.758 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -75.45 -43.87 47.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.899 176.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.613 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -67.82 -38.37 80.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.882 0.372 . . . . 0.0 111.039 -177.234 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.1 tp -101.01 -93.97 0.28 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 175.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.494 ' OD1' HG13 ' A' ' 10' ' ' VAL . 4.5 p30 -178.72 -19.87 0.0 OUTLIER 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.58 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.494 HG13 ' OD1' ' A' ' 9' ' ' ASP . 16.2 m -118.74 150.9 49.24 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.984 0.421 . . . . 0.0 110.768 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -94.85 -178.12 0.53 Allowed 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 123.405 2.737 . . . . 0.0 112.982 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.3 ptt85 -64.66 -27.56 69.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.682 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.8 p -63.3 -20.49 65.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.448 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.33 146.98 31.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.54 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.6 t -50.56 141.68 12.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.137 175.286 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.64 -31.92 64.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.004 0.43 . . . . 0.0 110.699 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.489 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 7.3 m-20 -65.91 -34.61 78.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.766 174.351 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.42 -43.26 77.57 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.222 178.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.537 HG12 ' CD1' ' A' ' 56' ' ' LEU . 2.0 mp -60.26 -38.95 79.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.35 0.595 . . . . 0.0 109.862 173.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -65.32 -34.72 79.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.912 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.81 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.37 -43.23 95.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 173.606 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.79 93.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.105 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -62.09 -42.65 99.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.135 176.314 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -66.83 -43.6 83.31 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.523 -177.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -70.15 -32.2 70.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.127 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -61.17 -43.47 98.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.423 0.63 . . . . 0.0 109.973 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.79 71.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.96 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.405 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.7 mp -68.37 -36.53 79.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.868 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -62.17 -39.57 93.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.885 0.374 . . . . 0.0 111.153 -178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -108.42 18.77 20.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.326 0.584 . . . . 0.0 110.614 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.506 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 14.2 t-80 -71.86 139.32 82.87 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.965 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.506 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 14.7 Cg_endo -55.97 -32.22 84.96 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 123.912 3.075 . . . . 0.0 114.424 -170.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.66 -28.92 65.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.794 0.33 . . . . 0.0 110.605 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.27 9.73 41.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.9 t-20 -104.5 134.28 19.75 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.8 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.73 -110.17 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.824 2.35 . . . . 0.0 113.489 -177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -97.67 -11.59 23.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.139 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -107.89 101.29 10.58 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.874 -176.795 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -98.94 -18.98 17.56 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.17 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -59.42 -47.61 84.82 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.416 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.9 p90 -72.06 -36.54 69.61 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.238 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.9 94.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.367 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HG3' ' HD2' ' A' ' 44' ' ' LYS . 6.7 pt-20 -68.9 -38.77 79.82 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.885 -178.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD2' ' HG3' ' A' ' 43' ' ' GLU . 12.7 mptt -68.61 -36.55 78.82 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.04 176.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 66.8 mmtt -64.71 -33.34 75.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -68.92 -39.94 79.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.328 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -62.59 -47.8 82.2 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.108 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 7.1 pt-20 -65.87 -44.08 86.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.314 -176.625 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 7.7 p -65.58 -38.34 82.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.237 -0.585 . . . . 0.0 111.144 -177.477 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.85 82.19 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.903 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -74.0 -41.31 62.08 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.157 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -74.44 -35.95 63.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.922 -173.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -69.18 -42.72 75.47 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 176.638 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -57.95 -48.49 79.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.809 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 52' ' ' ALA . 11.2 p -69.68 -41.64 80.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.598 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.731 HD22 ' HD3' ' A' ' 62' ' ' ARG . 2.9 tm? -73.91 -30.27 62.49 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.1 t -78.96 -17.57 55.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.153 -0.342 . . . . 0.0 110.861 -176.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.491 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 22.0 t70 -112.44 127.53 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.321 0.581 . . . . 0.0 110.504 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.41 -36.36 82.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.293 -175.33 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.51 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 73.6 t60 -68.37 -40.56 81.41 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.491 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 74.9 mmtt -61.17 -43.18 99.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.549 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.731 ' HD3' HD22 ' A' ' 56' ' ' LEU . 50.6 mtm105 -60.45 -45.08 94.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 178.301 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -60.9 -39.91 91.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.622 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.477 HG12 ' O ' ' A' ' 60' ' ' HIS . 33.8 mm -65.2 -44.26 95.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.078 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -61.59 -38.49 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.061 0.458 . . . . 0.0 110.516 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -64.99 -46.36 81.79 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.421 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.425 ' HD3' HD13 ' A' ' 64' ' ' ILE . 11.7 ptm180 -81.4 -28.44 34.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -176.714 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -93.49 -8.61 41.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.86 0.362 . . . . 0.0 110.799 -174.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -52.42 -50.53 47.24 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.703 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.07 -28.24 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.181 -0.509 . . . . 0.0 112.111 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.056 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.1 m . . . . . 0 C--O 1.226 -0.139 0 CA-C-O 121.343 0.592 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.831 ' HA ' HG12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -69.17 -38.01 78.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.293 -172.888 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.6 p90 -61.28 -33.27 73.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.147 173.449 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HG2' ' CE2' ' A' ' 5' ' ' TYR . 4.5 mt-10 -75.37 -44.21 46.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.626 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.831 HG12 ' HA ' ' A' ' 4' ' ' TYR . 11.0 pt -70.5 -40.33 77.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -169.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.486 HD13 HG23 ' A' ' 19' ' ' ILE . 18.5 mt -93.34 -75.61 0.49 Allowed 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.319 -176.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.0 t70 171.58 -24.48 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 O-C-N 124.338 1.024 . . . . 0.0 110.779 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 31.4 m -118.61 150.88 49.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.593 -170.147 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -91.36 -179.78 1.44 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.534 2.823 . . . . 0.0 113.067 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.658 ' HA ' ' HE2' ' A' ' 4' ' ' TYR . 32.9 mtm180 -60.14 -15.16 21.4 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.459 -167.324 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -82.18 -6.82 59.48 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.06 135.39 35.82 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.103 0.478 . . . . 0.0 111.044 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 t -81.05 166.11 21.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.619 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.31 -43.75 64.68 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -172.568 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 1.3 m-20 -65.74 -33.45 75.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.534 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -67.68 -40.49 84.41 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.486 HG23 HD13 ' A' ' 8' ' ' LEU . 1.8 mp -60.68 -41.52 88.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.056 173.351 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 36.4 ttmt -55.74 -43.71 76.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.18 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -69.37 -35.66 76.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.225 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.511 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -60.45 -42.51 96.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.082 0.468 . . . . 0.0 110.472 177.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.666 ' HD1' HG22 ' A' ' 49' ' ' VAL . 3.4 t80 -63.22 -43.23 98.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.864 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.406 ' O ' HD13 ' A' ' 28' ' ' LEU . 70.9 mtp180 -68.31 -44.17 76.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 10.1 ptm180 -66.1 -33.52 75.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.04 0.448 . . . . 0.0 110.492 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.622 ' HD3' ' HB ' ' A' ' 49' ' ' VAL . 35.7 tttp -70.42 -43.59 69.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.556 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.48 -47.74 81.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.566 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 24' ' ' ARG . 7.4 mp -62.88 -37.59 87.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.336 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.73 -30.17 71.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.975 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.591 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 59.1 m95 -108.46 17.56 21.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 111.479 -178.102 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -83.19 152.32 64.7 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 171.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -54.9 -27.04 51.63 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.845 3.03 . . . . 0.0 112.862 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.51 -34.79 77.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.36 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.14 -31.88 8.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.022 0.439 . . . . 0.0 111.554 -177.591 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -103.9 135.0 19.42 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 72.0 Cg_endo -71.12 -119.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.82 2.347 . . . . 0.0 114.589 -169.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.443 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 34.7 t70 -94.29 -7.65 41.3 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -167.194 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -93.55 101.64 13.82 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -94.52 -26.88 16.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -173.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.13 -46.51 88.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.273 -175.227 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.466 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 18.9 m-85 -72.96 -38.5 66.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.591 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.47 -46.15 89.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 3.1 pt-20 -70.29 -36.04 74.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.354 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.621 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 12.1 mmmt -58.83 -44.64 90.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.875 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 30.6 mmtp -66.84 -35.35 79.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.075 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -64.16 -40.25 95.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.296 174.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -67.01 -36.52 82.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.99 176.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 43.4 mm-40 -63.29 -44.69 94.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.014 0.435 . . . . 0.0 110.417 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.666 HG22 ' HD1' ' A' ' 23' ' ' TYR . 3.2 p -72.73 -37.38 55.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.92 177.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.62 -44.94 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.475 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.16 -42.85 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.05 0.453 . . . . 0.0 111.244 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.619 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -71.47 -34.84 70.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.392 0.615 . . . . 0.0 111.552 -176.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 28.0 t80 -71.58 -34.7 70.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.932 175.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.03 -49.99 75.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.119 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.836 HG23 ' HG3' ' A' ' 61' ' ' LYS . 7.1 p -65.18 -38.52 82.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.338 . . . . 0.0 110.737 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 56' ' ' LEU . 0.8 OUTLIER -73.73 -18.49 60.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.983 0.421 . . . . 0.0 110.96 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 t -78.27 -22.81 47.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.01 -174.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -112.15 124.56 52.7 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.15 -35.84 81.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.297 0.57 . . . . 0.0 110.98 -172.86 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.622 ' O ' HG12 ' A' ' 64' ' ' ILE . 48.9 t60 -70.6 -41.4 72.36 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.126 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.836 ' HG3' HG23 ' A' ' 55' ' ' VAL . 3.7 tppp? -61.87 -36.35 81.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.523 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -58.86 -46.55 87.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.516 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.1 pt-20 -71.71 -33.96 69.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.693 0.282 . . . . 0.0 110.343 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 60' ' ' HIS . 48.9 mm -64.51 -44.68 96.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 CA-C-O 121.129 0.49 . . . . 0.0 109.704 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -58.63 -41.99 87.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.874 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -72.85 -45.91 55.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.797 -175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 -86.72 -29.31 22.5 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -94.68 -7.23 41.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.126 0.489 . . . . 0.0 110.201 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 -37.45 94.55 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -60.7 -26.41 67.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.923 -1.138 . . . . 0.0 111.701 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.764 179.462 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 5' ' ' TYR . 3.1 m . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.618 ' O ' HG13 ' A' ' 7' ' ' ILE . 60.2 m-85 -68.31 -24.58 64.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.694 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' TYR . . . . . 0.515 ' CD1' ' HG2' ' A' ' 6' ' ' GLU . 4.3 p90 -57.63 -32.73 67.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.766 173.315 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 9.1 mm-40 -73.59 -44.32 57.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.021 0.438 . . . . 0.0 110.929 178.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.3 pp -71.11 -31.02 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.751 -174.972 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.418 HD21 HG23 ' A' ' 19' ' ' ILE . 61.1 tp -97.66 -79.94 0.46 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.601 -179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.637 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 25.1 t70 174.73 -40.56 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 30.1 m -121.72 157.49 56.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.527 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 5.9 Cg_exo -78.34 159.82 29.35 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.388 2.725 . . . . 0.0 112.486 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -62.44 -22.55 66.29 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.646 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -65.71 -17.97 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.277 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.98 146.46 43.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.819 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.8 t -59.61 156.67 13.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.07 -42.35 63.11 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -174.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -62.89 -34.57 77.68 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.71 -44.13 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.621 0.248 . . . . 0.0 111.112 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.418 HG23 HD21 ' A' ' 8' ' ' LEU . 2.0 mp -60.2 -44.61 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.338 0.589 . . . . 0.0 109.979 175.681 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -65.43 -36.98 85.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.471 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.829 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.076 176.761 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.54 -44.21 96.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.892 0.377 . . . . 0.0 110.756 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 1.1 t80 -57.98 -49.39 76.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.686 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 24' ' ' ARG . 25.9 mtp180 -68.0 -32.68 73.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.706 0.288 . . . . 0.0 111.176 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 22.3 ttm180 -63.75 -46.62 84.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.304 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -70.96 -40.85 71.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.067 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.27 -37.2 66.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.422 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -70.5 -36.86 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.473 178.606 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 13.1 mm-40 -63.31 -35.63 81.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.079 0.466 . . . . 0.0 110.616 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.437 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 29.4 m95 -105.75 19.0 21.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.651 -177.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.533 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.2 t-80 -72.3 141.41 83.34 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.533 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 13.4 Cg_endo -55.2 -31.06 74.37 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.844 3.029 . . . . 0.0 114.205 -168.036 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -70.61 -34.48 72.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.025 0.44 . . . . 0.0 111.183 177.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -90.26 -0.74 57.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.326 0.584 . . . . 0.0 110.08 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 26.8 t-20 -103.2 141.83 23.3 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.54 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 88.4 Cg_endo -74.89 -120.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.427 2.085 . . . . 0.0 112.695 -177.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.428 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 11.9 m-20 -100.15 -8.23 23.9 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -176.731 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -104.9 100.94 10.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.972 0.415 . . . . 0.0 110.467 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -96.88 -17.87 19.88 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.268 -177.622 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.453 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 6.6 tp10 -53.4 -46.93 69.91 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.451 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -73.47 -36.73 65.89 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.17 -45.78 91.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.742 0.306 . . . . 0.0 111.231 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 9.4 pt-20 -69.59 -37.64 77.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.496 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.644 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -60.56 -45.77 92.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.162 178.537 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -66.03 -39.28 90.06 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.281 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -59.04 -40.33 84.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.213 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.13 -40.97 82.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.716 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 13.4 mm-40 -63.64 -44.59 93.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.999 -176.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.61 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.3 p -72.26 -37.76 59.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.791 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.94 92.59 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.41 -38.85 68.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.981 0.42 . . . . 0.0 110.871 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.38 -36.95 71.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.666 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.77 -36.98 67.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.08 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.23 -47.49 85.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.571 HG23 ' HB3' ' A' ' 61' ' ' LYS . 9.0 p -69.78 -38.12 75.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.091 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.479 ' CD1' ' HB3' ' A' ' 4' ' ' TYR . 8.2 tt -71.59 -29.34 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -173.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -78.86 -19.38 52.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.669 0.271 . . . . 0.0 111.514 -174.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.483 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 21.7 t70 -113.13 133.38 55.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.292 0.568 . . . . 0.0 111.415 -176.487 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.536 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.96 -34.47 78.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.853 -177.769 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.448 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.3 m80 -68.96 -44.43 72.97 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.176 0.512 . . . . 0.0 110.124 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.571 ' HB3' HG23 ' A' ' 55' ' ' VAL . 14.1 mmmm -65.01 -37.94 89.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.566 -176.604 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 27.7 mtm180 -66.16 -45.58 80.44 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 -177.201 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 9.7 pt-20 -71.76 -32.71 67.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.893 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.605 HD13 ' HD3' ' A' ' 67' ' ' ARG . 30.1 mm -66.84 -36.01 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.441 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -63.18 -36.2 82.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.44 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -45.7 79.93 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.582 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.605 ' HD3' HD13 ' A' ' 64' ' ' ILE . 10.2 ptm180 -83.93 -47.13 11.35 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -94.65 -9.61 34.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.91 0.386 . . . . 0.0 111.239 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.59 -53.06 4.48 Favored Glycine 0 CA--C 1.507 -0.425 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.982 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 mmm-85 -61.18 -27.04 68.13 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.05 -0.575 . . . . 0.0 112.197 -177.503 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.614 -0.708 . . . . 0.0 110.609 -179.02 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' SER . . . . . 0.451 ' O ' HG23 ' A' ' 7' ' ' ILE . 15.8 m . . . . . 0 C--O 1.226 -0.159 0 CA-C-O 121.083 0.468 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.696 ' OH ' HG12 ' A' ' 19' ' ' ILE . 1.0 OUTLIER -63.59 -37.37 87.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.087 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -67.5 -31.92 72.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.389 . . . . 0.0 110.677 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -73.23 -44.35 59.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.392 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.802 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.5 pp -70.43 -39.12 76.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.315 -175.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 ' HB3' ' A' ' 22' ' ' ALA . 38.0 tp -101.47 -82.27 0.47 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.12 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.9 t70 174.08 -29.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.029 -175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -119.56 155.44 54.35 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.098 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.19 -177.63 3.97 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.032 2.488 . . . . 0.0 112.656 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.7 mtp180 -78.64 -9.37 59.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.846 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -74.3 -9.0 58.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.548 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.55 144.22 28.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.638 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.4 m -80.8 167.67 19.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.749 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.91 -43.11 65.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.679 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.42 -35.86 78.73 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.166 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.548 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 41.1 t0 -70.22 -43.76 69.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.306 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.696 HG12 ' OH ' ' A' ' 4' ' ' TYR . 1.2 mp -61.12 -41.76 90.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.743 175.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 58.0 mttm -55.6 -45.9 77.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.001 173.587 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -35.01 79.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.502 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.676 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -66.36 -43.9 84.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.842 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 3.4 p90 -66.43 -37.15 84.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.966 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 24' ' ' ARG . 26.5 mtp180 -57.2 -44.81 83.99 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 123.153 0.283 . . . . 0.0 111.164 177.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 7.2 ptm180 -67.3 -34.43 77.37 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.103 0.478 . . . . 0.0 110.427 -177.702 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -67.54 -38.42 84.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.121 175.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ALA . . . . . 0.529 ' HA ' ' CE2' ' A' ' 30' ' ' TRP . . . -55.49 -40.64 71.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.306 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 28' ' ' LEU . 1.7 mm? -66.6 -35.9 81.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.055 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -62.39 -34.78 77.39 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.529 ' CE2' ' HA ' ' A' ' 27' ' ' ALA . 47.4 p-90 -105.14 12.27 32.22 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 110.745 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.611 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 16.4 t-80 -72.19 142.21 84.53 Favored Pre-proline 0 C--N 1.321 -0.662 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 15.0 Cg_endo -54.44 -27.95 51.9 Favored 'Trans proline' 0 N--CA 1.482 0.797 0 C-N-CA 124.111 3.207 . . . . 0.0 114.616 -168.584 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -70.65 -29.84 66.29 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.902 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -91.69 -46.15 8.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.883 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.456 ' O ' ' HA ' ' A' ' 32' ' ' PRO . 67.2 t30 -103.42 129.12 26.05 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 41.6 Cg_endo -91.1 -101.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.577 2.185 . . . . 0.0 115.103 -167.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -86.32 -8.56 57.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.821 0.343 . . . . 0.0 111.84 -168.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -94.85 99.9 11.88 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.828 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 0.9 OUTLIER -93.91 -18.38 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.964 178.866 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 8.5 tp10 -54.95 -46.12 74.96 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.121 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -72.14 -40.77 67.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.76 177.72 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HA ' ' HB2' ' A' ' 30' ' ' TRP . . . -62.38 -45.97 90.73 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.225 -174.556 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.0 pt-20 -71.71 -37.22 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.995 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -65.96 -40.29 91.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.671 -177.938 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 49' ' ' VAL . 67.1 mmtt -69.28 -35.31 75.91 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.258 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -59.24 -42.65 91.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.949 173.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -66.77 -42.84 85.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.763 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.28 -44.45 95.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.244 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 8.3 p -72.59 -37.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.304 -178.064 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -61.4 -45.94 92.24 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.14 -176.636 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 55' ' ' VAL . 13.2 pt-20 -72.15 -43.23 64.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.021 0.439 . . . . 0.0 110.897 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.802 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.5 -38.95 68.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.86 -173.435 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.572 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -70.99 -42.6 69.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.8 OUTLIER -58.64 -49.73 76.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.483 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.649 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.3 p -70.06 -45.17 77.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-N 116.343 -0.389 . . . . 0.0 112.003 -178.267 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.916 HD23 ' HD3' ' A' ' 62' ' ' ARG . 12.4 mt -74.87 -29.69 61.09 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.5 t -80.09 -18.36 50.17 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.682 -177.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -111.91 127.45 55.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.646 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -69.19 -28.85 66.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.235 -173.466 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' HG12 ' A' ' 64' ' ' ILE . 49.6 m80 -68.63 -43.17 76.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.46 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.649 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.8 OUTLIER -70.25 -38.26 75.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.481 -178.922 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.916 ' HD3' HD23 ' A' ' 56' ' ' LEU . 12.2 mmm180 -58.15 -38.19 76.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.968 175.483 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.447 ' O ' ' HD2' ' A' ' 67' ' ' ARG . 6.1 mm-40 -66.19 -42.91 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.383 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 60' ' ' HIS . 41.5 mm -64.01 -44.29 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.773 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HB2' HG21 ' A' ' 55' ' ' VAL . 52.0 t80 -67.08 -37.37 83.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.881 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -73.17 -46.3 51.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.024 0.44 . . . . 0.0 111.443 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 63' ' ' GLU . 4.1 ptm85 -81.28 -44.09 18.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.619 -173.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -94.89 -10.46 31.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -70.07 -49.56 33.41 Favored Glycine 0 CA--C 1.505 -0.57 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.649 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -65.2 -25.37 67.68 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.958 -0.621 . . . . 0.0 111.943 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 28.1 mm-40 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.042 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.575 ' O ' HG13 ' A' ' 7' ' ' ILE . 45.9 m-85 -68.37 -28.88 67.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.948 0.404 . . . . 0.0 111.114 -176.98 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -64.22 -32.46 74.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.006 0.432 . . . . 0.0 110.771 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.03 -43.84 51.32 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.313 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.4 pp -70.36 -37.83 72.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.34 -174.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -100.72 -84.62 0.43 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.8 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.818 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 31.8 t70 176.35 -33.24 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.426 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.3 m -119.99 156.77 54.16 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.145 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 86.6 Cg_endo -78.54 -177.49 3.93 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.92 2.413 . . . . 0.0 112.888 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -77.53 -21.78 52.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.041 0.448 . . . . 0.0 111.126 -178.004 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -78.76 1.79 21.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.582 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.57 145.79 27.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 0.0 110.737 177.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.1 t -70.51 160.84 31.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.79 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.43 -42.7 64.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 0.0 111.667 -174.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -61.62 -35.66 78.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.545 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -63.27 -45.77 89.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.4 HG12 ' CD2' ' A' ' 56' ' ' LEU . 2.0 mp -62.38 -45.63 98.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.339 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.71 -39.91 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.773 0.32 . . . . 0.0 111.0 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.776 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.91 -42.15 81.58 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 177.289 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.818 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.78 -43.48 98.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.958 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -62.16 -47.87 82.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.777 178.704 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.555 ' HG3' ' CE2' ' A' ' 23' ' ' TYR . 88.8 mtt180 -69.29 -39.32 78.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 5.0 ptp180 -63.0 -38.17 90.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.632 178.095 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HG3' ' HZ3' ' A' ' 30' ' ' TRP . 65.6 tttm -69.41 -40.75 77.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.221 0.534 . . . . 0.0 110.042 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.57 94.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.597 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.4 mp -71.56 -37.2 71.11 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -67.84 -28.59 67.69 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.608 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 12.5 m-90 -109.01 18.62 20.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.551 0.691 . . . . 0.0 110.698 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.498 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 52.6 t-80 -74.06 142.87 79.84 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 172.639 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.765 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 11.3 Cg_endo -54.29 -28.92 55.07 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.504 2.802 . . . . 0.0 113.343 -173.679 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.45 -23.76 63.71 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.251 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -122.51 18.23 10.47 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.765 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -102.27 145.83 31.22 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.536 -175.701 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -81.79 -110.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 122.997 2.464 . . . . 0.0 113.421 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -93.48 -11.68 31.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.774 0.321 . . . . 0.0 111.524 -174.17 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 41' ' ' PHE . 7.3 p30 -106.92 114.71 28.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.95 0.405 . . . . 0.0 111.036 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 5.5 mptt -103.86 -32.3 9.36 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.59 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -66.93 -43.99 81.81 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.496 177.96 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.469 ' HB2' ' HB2' ' A' ' 38' ' ' ASN . 75.0 m-85 -72.33 -37.39 68.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.095 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -61.46 -45.41 94.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.795 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -67.65 -35.77 79.51 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.146 176.742 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.603 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -61.93 -40.87 97.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.467 177.709 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -63.87 -34.6 78.31 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.193 0.52 . . . . 0.0 109.666 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.77 -41.8 87.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.042 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -57.68 -44.9 86.12 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 44' ' ' LYS . 50.8 mt-10 -63.01 -45.6 91.59 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.054 0.454 . . . . 0.0 110.277 -177.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.616 HG22 ' HD1' ' A' ' 23' ' ' TYR . 9.7 p -70.88 -37.18 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.126 -172.599 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -63.9 -45.56 88.78 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.041 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -72.66 -41.81 65.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.066 0.46 . . . . 0.0 110.747 -179.117 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.548 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -73.14 -43.66 61.25 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.996 -174.341 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.477 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -66.97 -35.38 79.84 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.837 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 13.5 tp10 -60.73 -50.78 72.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.607 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.818 ' HA ' ' HD2' ' A' ' 61' ' ' LYS . 10.0 p -71.35 -39.55 72.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.582 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.436 HD23 ' O ' ' A' ' 56' ' ' LEU . 9.4 tt -72.83 -28.9 62.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -173.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -78.0 -15.33 59.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.409 -175.139 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 30.5 t70 -112.15 121.46 45.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.502 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -61.67 -34.33 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.549 -175.351 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -69.76 -44.5 70.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.776 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.818 ' HD2' ' HA ' ' A' ' 55' ' ' VAL . 22.8 ttmm -71.01 -43.37 68.1 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.915 -174.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 27.1 ptt180 -67.57 -38.57 84.3 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.511 -177.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 8.9 pt-20 -72.68 -36.39 67.88 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.498 177.6 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.91 -39.36 85.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.61 -35.32 80.63 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.007 0.432 . . . . 0.0 110.33 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -72.8 -48.9 34.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.896 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.23 -42.13 11.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -95.04 -10.67 30.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 0.0 110.359 -170.382 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.14 -46.58 93.69 Favored Glycine 0 CA--C 1.505 -0.54 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.695 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -61.9 -26.67 68.31 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.451 -0.874 . . . . 0.0 111.903 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.419 -177.566 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 CA--C 1.53 0.202 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.736 ' HA ' HG12 ' A' ' 7' ' ' ILE . 34.1 m-85 -63.09 -28.06 69.82 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.296 0.57 . . . . 0.0 109.823 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -61.26 -37.62 83.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.205 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -74.0 -42.6 60.13 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.132 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.853 HD12 ' HB1' ' A' ' 52' ' ' ALA . 11.2 pt -70.98 -41.99 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.697 -172.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.55 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 15.6 mt -102.83 -74.82 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.015 0.436 . . . . 0.0 110.312 178.004 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.4 t70 172.07 -31.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.804 -173.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 25.1 m -120.98 150.62 53.59 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.831 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 10' ' ' VAL . 7.6 Cg_endo -87.5 -172.2 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.247 2.632 . . . . 0.0 112.968 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.497 ' HB3' ' CD2' ' A' ' 4' ' ' TYR . 15.7 ptm180 -68.31 -21.29 64.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.717 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p -67.94 -15.96 63.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.979 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.05 144.21 29.23 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.084 176.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 p -72.97 148.17 44.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.136 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.2 -31.08 41.14 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -167.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 2.9 m-20 -65.71 -35.27 80.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.37 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.39 -37.33 82.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.487 0.66 . . . . 0.0 109.433 176.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.428 HG23 HD13 ' A' ' 8' ' ' LEU . 1.7 mp -60.31 -46.78 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.2 175.637 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 17' ' ' ASP . 21.1 pttm -66.01 -33.86 76.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.004 0.431 . . . . 0.0 110.359 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 7.8 tptm -66.71 -41.63 87.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.377 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -61.68 -40.16 93.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.476 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -42.18 81.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.762 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -64.92 -38.18 90.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.991 0.424 . . . . 0.0 110.899 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -67.3 -44.38 79.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 22' ' ' ALA . 26.1 mtpp -62.83 -38.86 92.43 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.065 0.459 . . . . 0.0 109.804 176.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.17 -46.16 75.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.881 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.6 -36.93 73.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.038 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -62.07 -39.82 93.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.535 -176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.533 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 96.6 m95 -109.02 18.03 21.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.87 0.367 . . . . 0.0 111.87 -176.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.61 145.66 71.72 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 170.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 14.8 Cg_endo -55.27 -28.42 62.13 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.02 3.147 . . . . 0.0 113.695 -170.381 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.48 -29.26 69.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.958 0.408 . . . . 0.0 111.023 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -108.44 14.83 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.087 0.47 . . . . 0.0 110.329 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.572 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 28.6 t-20 -115.33 134.46 22.58 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -89.04 -107.81 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.838 2.359 . . . . 0.0 113.61 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.73 -10.22 23.45 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ASN . . . . . 0.485 ' HB3' ' HD1' ' A' ' 41' ' ' PHE . 88.0 m-20 -106.39 100.6 10.12 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.058 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -91.44 -28.66 17.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.315 -0.402 . . . . 0.0 109.993 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -56.4 -43.94 79.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.565 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 83.8 m-85 -66.99 -37.86 84.99 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.691 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . 0.533 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.46 -44.95 81.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.347 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -69.36 -37.96 77.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.594 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.737 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 9.2 mtpm? -65.28 -46.1 81.81 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.719 176.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -64.61 -34.51 78.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.472 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.74 -40.86 98.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.661 174.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.419 ' HE3' ' OE2' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -70.1 -33.94 72.49 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.435 176.202 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.737 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 17.3 mm-40 -63.8 -45.54 89.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 110.616 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.08 -36.13 61.78 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.181 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.67 -46.57 81.05 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.181 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 11.5 pt-20 -73.3 -43.54 60.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.109 0.481 . . . . 0.0 110.807 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.853 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -70.3 -38.92 75.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.718 -173.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -72.37 -37.82 68.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.308 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.16 -50.35 73.54 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.18 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.9 p -65.81 -42.74 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.0 tp -74.35 -29.24 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.6 t -79.74 -14.73 58.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.82 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.671 ' HB3' ' HD3' ' A' ' 61' ' ' LYS . 38.5 m-20 -109.68 121.37 45.06 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -66.03 -34.98 79.32 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.825 -173.154 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HA ' ' OE2' ' A' ' 63' ' ' GLU . 64.8 t60 -71.93 -38.13 69.9 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.337 177.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HD3' ' HB3' ' A' ' 58' ' ' ASP . 1.8 mptm? -68.69 -45.06 72.65 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.777 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HE ' ' HB2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -68.03 -33.91 75.49 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.457 -178.119 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.555 ' OE2' ' HA ' ' A' ' 60' ' ' HIS . 15.8 pt-20 -69.65 -37.0 76.59 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.552 -0.459 . . . . 0.0 109.835 177.882 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.0 mm -66.31 -44.09 91.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.062 175.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.61 -34.43 76.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.804 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.19 -47.13 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.6 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -89.4 -34.37 16.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -105.08 -4.1 22.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.221 0.534 . . . . 0.0 110.909 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.64 63.69 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.315 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -59.97 -37.57 79.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.005 -0.598 . . . . 0.0 111.848 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.627 -0.702 . . . . 0.0 111.088 -176.349 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 C--O 1.232 0.147 0 CA-C-O 121.17 0.509 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.681 ' HA ' HG13 ' A' ' 7' ' ' ILE . 60.9 m-85 -66.42 -27.97 68.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.468 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -63.99 -37.17 86.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.391 0.615 . . . . 0.0 109.553 175.416 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -73.14 -44.17 60.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.207 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.848 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.75 -37.8 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.446 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LEU . . . . . 0.433 ' N ' HD12 ' A' ' 7' ' ' ILE . 34.9 tp -99.89 -87.81 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.504 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' LEU . 5.7 p-10 170.65 -11.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.212 0.605 . . . . 0.0 110.376 177.786 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 19' ' ' ILE . 19.8 m -119.95 151.67 52.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.502 174.973 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -90.31 -168.18 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.217 2.611 . . . . 0.0 113.639 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -78.53 -31.48 47.57 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 m -70.58 -7.29 42.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.995 0.426 . . . . 0.0 111.29 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.3 144.06 40.47 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.036 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.7 t -74.94 154.93 37.93 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.229 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.24 -41.12 62.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.92 0.391 . . . . 0.0 111.434 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.42 -34.41 77.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.578 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -68.85 -41.13 78.86 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.479 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.0 mp -60.66 -41.88 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.314 0.578 . . . . 0.0 109.692 172.275 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.413 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -59.15 -42.66 91.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.011 177.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -42.77 86.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.607 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.33 -41.47 93.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.567 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TYR . . . . . 0.67 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -64.22 -42.02 96.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.921 175.085 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -65.03 -43.53 92.09 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 25.3 ptt180 -69.86 -39.21 76.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -64.54 -39.82 94.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.24 -39.26 92.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.122 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -40.29 90.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.066 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 26.9 mm-40 -62.85 -37.32 86.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.261 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' TRP . . . . . 0.43 ' CE3' ' HB3' ' A' ' 45' ' ' LYS . 13.2 m0 -110.18 19.42 18.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.086 0.47 . . . . 0.0 111.269 -176.739 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.71 141.2 82.07 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.58 -29.11 68.47 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.382 2.722 . . . . 0.0 112.362 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.22 -33.31 75.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.77 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -115.83 18.9 15.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.734 -173.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.46 ' OD1' ' HD2' ' A' ' 39' ' ' LYS . 26.8 t-20 -115.51 135.16 22.57 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.851 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 58.8 Cg_endo -88.12 -106.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.924 2.416 . . . . 0.0 114.05 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -97.06 -8.41 30.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -171.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -103.25 99.41 9.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 12.4 mmmm -101.99 -30.0 11.46 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.227 -171.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -61.33 -45.53 94.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.002 -174.273 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -72.04 -36.4 69.62 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.168 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.58 -44.3 96.66 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.727 0.298 . . . . 0.0 111.007 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.55 -42.3 74.77 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.081 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -70.16 -37.71 75.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.324 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 64.4 mmtt -68.26 -35.18 77.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.657 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -62.84 -39.71 95.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.694 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -65.53 -44.01 88.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.388 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -66.34 -42.62 87.86 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.77 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.67 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.0 p -66.11 -37.29 79.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.876 178.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -62.19 -45.44 93.37 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 111.599 -178.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.56 -37.65 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.071 0.462 . . . . 0.0 110.41 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.848 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.4 -39.29 59.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.085 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.528 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -72.12 -35.34 69.11 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 179.01 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -61.63 -48.11 82.34 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.577 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.63 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 14.3 p -65.63 -38.8 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.955 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.441 HD22 ' HB3' ' A' ' 4' ' ' TYR . 52.5 tp -72.67 -28.19 62.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 t -78.57 -20.09 51.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.989 0.423 . . . . 0.0 110.328 -176.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.751 ' HB2' ' HB2' ' A' ' 61' ' ' LYS . 73.1 m-20 -111.77 121.85 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.595 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 3.4 mppt? -67.2 -34.29 77.19 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' HG12 ' A' ' 64' ' ' ILE . 81.9 m-70 -69.73 -32.86 71.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.076 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.751 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.2 tppp? -71.41 -41.68 69.28 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.63 ' HG3' ' O ' ' A' ' 55' ' ' VAL . 25.7 mtp180 -61.98 -42.6 99.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.576 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 13.1 pt-20 -67.55 -33.12 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.202 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.6 mm -65.2 -44.11 95.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 175.012 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -59.15 -37.48 77.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.259 0.552 . . . . 0.0 109.876 175.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -72.27 -47.25 51.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.144 -176.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -88.49 -37.51 15.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.504 ' HA ' ' HG2' ' A' ' 71' ' ' GLU . 32.3 t80 -95.44 -9.49 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.877 0.37 . . . . 0.0 110.543 -173.825 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.69 -48.01 84.69 Favored Glycine 0 CA--C 1.51 -0.271 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.635 175.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.41 -25.98 68.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.473 -0.864 . . . . 0.0 111.465 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 68' ' ' TYR . 18.4 mm-40 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.07 -176.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.7 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' TYR . . . . . 0.575 ' CD1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -62.69 -38.08 88.97 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 122.002 -0.436 . . . . 0.0 111.32 -176.956 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -61.3 -32.14 71.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.034 174.781 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -73.71 -45.09 54.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.916 0.388 . . . . 0.0 111.077 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ILE . . . . . 0.782 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -71.72 -30.99 40.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.813 -176.403 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.0 tp -99.66 -87.03 0.37 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.424 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.75 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 23.9 t70 177.85 -33.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.038 0.447 . . . . 0.0 110.853 -174.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.02 156.52 56.77 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.417 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -92.99 174.48 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.487 2.791 . . . . 0.0 112.844 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.801 ' HD3' ' H ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -57.34 -22.67 43.9 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 114.711 -1.132 . . . . 0.0 113.842 -168.974 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 t -58.64 -24.12 60.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.925 0.393 . . . . 0.0 111.113 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.888 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -78.82 143.78 35.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.144 0.497 . . . . 0.0 111.719 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.7 t -78.54 164.66 24.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.658 173.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.14 -34.44 44.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.168 0.509 . . . . 0.0 111.451 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.99 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.813 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ASP . . . . . 0.888 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 11.3 t70 -69.34 -36.61 77.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.808 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.12 -43.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.995 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -65.13 -37.86 88.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.043 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.627 ' HA ' ' HE ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -70.24 -35.28 73.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.357 175.413 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.75 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -59.82 -42.09 92.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.26 0.552 . . . . 0.0 110.736 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.66 -40.85 96.13 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.408 173.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.627 ' HE ' ' HA ' ' A' ' 21' ' ' LYS . 9.9 mtm180 -67.19 -45.57 76.51 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.897 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 29' ' ' GLN . 1.6 ptm180 -64.81 -32.63 74.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.865 0.364 . . . . 0.0 110.336 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 0.6 OUTLIER -71.31 -38.89 71.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.126 0.489 . . . . 0.0 110.139 176.979 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.19 -37.09 66.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.74 171.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 8.1 mp -67.86 -35.72 79.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.423 175.397 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' A' ' 26' ' ' LYS . 50.9 mt-30 -62.24 -34.23 76.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.056 0.455 . . . . 0.0 110.295 177.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -106.39 18.72 21.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.504 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.558 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.42 152.05 94.07 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.445 -178.439 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PRO . . . . . 0.704 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 11.2 Cg_endo -54.92 -29.36 63.54 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.231 2.62 . . . . 0.0 112.791 -178.157 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.734 ' HB2' ' HD2' ' A' ' 34' ' ' LYS . 1.3 m-20 -60.92 -34.78 75.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.338 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LYS . . . . . 0.734 ' HD2' ' HB2' ' A' ' 33' ' ' ASP . 0.1 OUTLIER -108.11 18.06 21.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.719 -178.256 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ASN . . . . . 0.704 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.4 t-20 -116.18 136.27 22.98 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.097 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.433 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 53.1 Cg_endo -85.73 -121.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.947 2.432 . . . . 0.0 112.723 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . 0.433 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 43.7 m-20 -97.44 -9.17 27.77 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.894 0.378 . . . . 0.0 111.137 -177.098 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.34 101.95 11.46 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 51.4 mttm -99.42 -21.04 16.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -57.27 -42.89 82.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -67.35 -35.6 79.72 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.829 0.347 . . . . 0.0 110.309 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 24.3 mt-10 -69.44 -42.24 75.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 109.825 176.097 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 46.8 tptt -57.67 -46.7 83.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.705 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 65.1 mmtt -66.0 -35.49 80.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.29 -39.9 89.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.789 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 95.2 mttt -66.7 -44.21 82.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.222 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 16.5 mm-40 -65.11 -41.5 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 p -71.04 -37.3 66.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.603 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.15 92.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.607 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 9.6 pt-20 -71.36 -41.6 69.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.173 0.511 . . . . 0.0 110.372 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ALA . . . . . 0.782 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -68.65 -42.7 77.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.534 -174.642 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -38.31 71.35 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -69.89 -43.45 71.75 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.511 -175.339 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.605 HG22 ' HD2' ' A' ' 62' ' ' ARG . 11.8 p -68.27 -37.23 77.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.588 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 56' ' ' LEU . 1.9 tm? -72.17 -26.0 61.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.907 0.384 . . . . 0.0 110.327 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 t -76.32 -19.85 57.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.076 -174.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.624 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 23.1 t70 -112.36 121.63 45.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.42 0.629 . . . . 0.0 109.916 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.908 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.68 -37.22 85.88 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.99 -174.441 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 47.0 t60 -68.91 -39.54 79.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.287 -179.208 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . 0.624 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 41.5 mmtm -60.96 -36.15 78.64 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.219 177.029 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ARG . . . . . 0.605 ' HD2' HG22 ' A' ' 55' ' ' VAL . 9.8 mmm180 -63.81 -46.39 85.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.203 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.2 pt-20 -65.43 -38.85 91.12 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.718 -0.393 . . . . 0.0 109.983 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 ' HD3' ' A' ' 67' ' ' ARG . 44.5 mm -67.8 -44.09 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.551 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -60.93 -42.79 98.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.259 -176.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.29 -42.06 62.85 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' HD3' HD13 ' A' ' 64' ' ' ILE . 8.0 ptm180 -72.17 -30.9 65.44 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 111.452 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.431 ' HB3' ' O ' ' A' ' 64' ' ' ILE . 0.1 OUTLIER -103.96 -6.13 21.54 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.421 0.629 . . . . 0.0 110.943 -174.446 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.47 -48.99 67.79 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.472 -0.785 . . . . 0.0 113.619 -178.377 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -58.4 -46.23 86.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -176.055 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.394 -0.813 . . . . 0.0 110.513 -179.521 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.87 -44.68 3.77 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.011 0.434 . . . . 0.0 110.523 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 m 67.64 -7.12 0.6 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.308 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.638 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 30.2 t80 -59.13 -35.34 73.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -177.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -56.82 -42.61 79.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.139 0.495 . . . . 0.0 110.21 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -74.63 -45.09 47.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.928 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.901 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.2 pp -72.8 -40.88 61.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -167.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.67 -106.08 0.25 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.322 -169.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.461 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 26.6 t70 -140.53 -35.71 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.84 -171.315 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.542 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 31.6 m -129.79 162.08 55.62 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.693 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.542 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.8 Cg_endo -62.11 160.78 28.84 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.589 2.859 . . . . 0.0 113.108 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.6 106.74 11.85 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.909 0.861 . . . . 0.0 109.182 175.679 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -176.65 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 145.59 47.35 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.086 173.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -68.08 165.74 17.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.19 -177.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.577 ' HA ' HD13 ' A' ' 19' ' ' ILE . . . -51.88 -30.11 22.66 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.074 0.464 . . . . 0.0 111.843 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.5 -44.39 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -68.84 -34.99 76.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.212 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' CZ ' ' A' ' 4' ' ' TYR . 1.9 mp -57.54 -47.8 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.673 176.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -65.83 -38.29 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.056 0.455 . . . . 0.0 110.126 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 1.2 tmtt? -69.68 -35.42 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.733 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -63.85 -35.86 82.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 110.462 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.682 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -64.01 -48.04 77.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.188 173.456 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 71.9 mtp180 -64.68 -43.25 94.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.357 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 8.9 ptp85 -65.21 -39.96 93.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.719 0.295 . . . . 0.0 110.439 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HA ' ' HB3' ' A' ' 29' ' ' GLN . 24.1 ttmm -71.73 -35.81 70.27 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.573 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.87 -44.96 74.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.189 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 10.7 mp -71.48 -34.81 70.51 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.782 175.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 33.5 tt0 -61.66 -36.82 81.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.393 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.558 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 95.3 m95 -111.85 19.35 18.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.342 0.592 . . . . 0.0 110.82 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.612 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 27.7 t60 -72.14 145.04 88.07 Favored Pre-proline 0 C--N 1.322 -0.61 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.612 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.4 Cg_endo -54.21 -28.73 53.36 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.866 3.044 . . . . 0.0 113.633 -174.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.38 -25.17 65.83 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.123 0.487 . . . . 0.0 110.134 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.72 2.59 21.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.117 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.602 HD21 ' HG3' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -104.04 140.29 20.93 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 120.939 0.399 . . . . 0.0 110.216 -176.108 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 62.6 Cg_endo -87.34 -119.52 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.047 2.498 . . . . 0.0 112.757 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.409 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 4.0 m-20 -86.91 -8.05 57.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.114 0.483 . . . . 0.0 111.157 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.569 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 55.1 m-80 -102.47 102.95 13.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.242 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.602 ' HG3' HD21 ' A' ' 35' ' ' ASN . 0.1 OUTLIER -97.77 -31.07 12.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.949 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -61.75 -44.88 96.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.205 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 82.6 m-85 -66.79 -37.43 84.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.448 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -68.15 -45.99 72.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.029 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.3 pt-20 -70.3 -36.22 74.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.546 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 8.5 ttmm -59.53 -44.44 93.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 120.864 0.364 . . . . 0.0 110.147 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' HG12 ' A' ' 49' ' ' VAL . 62.9 mmtt -68.12 -39.64 82.72 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -62.44 -41.59 98.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.377 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 51.3 mtmt -68.34 -44.11 76.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.749 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 12.7 pt-20 -72.27 -36.28 68.97 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.682 HG21 ' HA ' ' A' ' 23' ' ' TYR . 7.8 p -67.21 -38.38 80.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.085 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.84 -44.46 96.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 11.5 pt-20 -72.7 -40.66 66.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.967 0.413 . . . . 0.0 111.083 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.901 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.04 -40.03 68.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.454 -175.011 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -69.28 -34.23 74.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 175.362 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.46 -50.26 74.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.901 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.606 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 3.2 m -67.93 -40.98 84.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.5 HD23 HG12 ' A' ' 19' ' ' ILE . 31.1 tp -73.1 -28.83 62.5 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.169 -0.612 . . . . 0.0 112.06 -175.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.9 t -77.98 -22.63 49.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.784 0.326 . . . . 0.0 110.228 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.826 ' HB3' ' HG3' ' A' ' 61' ' ' LYS . 11.7 t70 -112.41 121.67 45.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.082 0.468 . . . . 0.0 109.747 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.594 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 3.0 mptp? -66.56 -34.99 79.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.005 -170.175 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.514 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.5 t-80 -69.68 -42.16 74.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.517 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.826 ' HG3' ' HB3' ' A' ' 58' ' ' ASP . 4.6 mtpt -60.49 -33.76 73.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.623 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 14.9 mtm105 -60.63 -46.67 89.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.03 0.443 . . . . 0.0 110.654 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 14.8 pt-20 -71.84 -30.12 65.13 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.592 -176.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.823 HD13 ' HD3' ' A' ' 67' ' ' ARG . 47.8 mm -63.65 -38.02 81.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -65.24 -39.92 93.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.277 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -72.83 -45.73 56.8 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.823 ' HD3' HD13 ' A' ' 64' ' ' ILE . 9.0 ptm180 -71.61 -41.71 68.56 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 122.33 -0.231 . . . . 0.0 111.388 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.01 -0.46 57.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.512 0.673 . . . . 0.0 109.773 -174.216 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.59 -48.76 8.66 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 166.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -65.75 -45.51 82.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.431 -0.885 . . . . 0.0 111.585 175.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.953 179.146 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.2 ttp . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.646 0.26 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.37 -36.34 60.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.769 0.318 . . . . 0.0 111.247 -177.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.1 m 66.62 -2.28 1.11 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.225 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.503 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -61.32 -36.85 81.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.862 -178.964 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.551 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 2.1 p90 -57.35 -39.3 75.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.153 175.448 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.551 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 8.0 mm-40 -73.88 -44.36 55.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.463 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.52 HD11 HD11 ' A' ' 56' ' ' LEU . 2.3 pp -71.15 -31.73 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.715 -173.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.7 tp -97.39 -78.37 0.48 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.801 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 177.56 -44.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.251 0.548 . . . . 0.0 110.222 -175.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 27.5 m -120.5 156.14 55.92 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.642 -170.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.475 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 87.1 Cg_endo -81.74 174.66 10.13 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.201 2.6 . . . . 0.0 112.042 176.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' HG2' ' H ' ' A' ' 12' ' ' ARG . 7.3 ptm85 -78.05 -8.92 58.82 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.392 -174.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 m -69.35 -13.85 62.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.082 0.467 . . . . 0.0 110.776 176.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.98 144.27 28.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.6 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 m -72.74 163.59 27.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.738 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.28 -40.14 61.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -173.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.15 -34.52 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.358 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 21.1 t70 -69.66 -40.03 76.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.81 -40.93 88.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.825 172.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.887 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 26.7 ttpp -57.59 -43.33 84.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.556 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.781 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.2 mmpt? -63.54 -35.98 82.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.537 174.811 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.55 -47.88 77.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.887 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 12.4 p90 -70.09 -36.93 75.26 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.894 -0.722 . . . . 0.0 109.849 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.8 mmt180 -57.52 -45.7 84.69 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.893 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 6.3 ptp180 -67.07 -39.18 86.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.797 0.332 . . . . 0.0 110.514 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -64.76 -38.27 90.42 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.92 -36.27 80.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.074 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 6.4 mp -69.68 -36.21 75.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.404 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.23 -37.4 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.769 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -108.22 20.27 18.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.808 0.337 . . . . 0.0 111.064 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.2 t-80 -72.02 140.67 83.38 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.343 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.526 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 9.3 Cg_endo -53.07 -37.28 79.02 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.731 2.287 . . . . 0.0 113.327 -167.028 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -67.88 -26.49 66.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 111.162 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 12.9 mmtp -107.34 15.12 25.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.498 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -107.76 134.33 20.1 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.365 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 95.7 Cg_endo -81.26 -120.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 122.951 2.434 . . . . 0.0 113.251 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.42 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 20.9 m-20 -97.04 -9.33 28.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 111.613 -173.208 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.451 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 91.2 m-20 -100.69 101.62 12.54 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.578 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.5 OUTLIER -93.53 -29.63 15.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.314 -174.581 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -54.43 -44.84 72.77 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.549 0.531 . . . . 0.0 110.979 -174.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 89.9 m-85 -62.61 -43.11 99.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.03 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.84 96.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.016 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 15.7 mt-10 -69.56 -44.14 71.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.024 0.44 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -64.98 -41.48 95.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.287 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 66.5 mmtt -71.69 -34.57 69.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.661 0.267 . . . . 0.0 110.333 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -60.76 -39.27 88.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.085 0.469 . . . . 0.0 109.751 174.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.94 -45.77 84.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.488 174.718 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -63.74 -43.93 95.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.467 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 23' ' ' TYR . 11.2 p -67.35 -36.72 77.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.782 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.695 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . . . -63.87 -45.77 87.93 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.91 0.386 . . . . 0.0 111.74 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -70.69 -36.8 73.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.544 0.688 . . . . 0.0 109.979 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -73.97 -45.94 47.06 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.662 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.695 ' CD2' ' HA ' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.13 -34.77 78.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.998 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -51.24 68.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.322 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' A' ' 52' ' ' ALA . 14.6 p -71.84 -39.09 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 52' ' ' ALA . 46.6 mt -68.47 -24.29 64.68 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -172.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.8 t -78.3 -23.11 47.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.907 0.385 . . . . 0.0 110.36 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -114.33 121.58 44.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.0 111.027 -177.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.28 -36.25 83.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.691 -178.064 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.443 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 32.2 m-70 -69.14 -41.86 76.76 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.853 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 61' ' ' LYS . 26.7 ttmt -63.09 -33.78 76.18 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.07 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -62.13 -37.14 84.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.821 174.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 41.5 mt-10 -63.38 -43.08 98.62 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.114 0.483 . . . . 0.0 110.175 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.14 -44.93 95.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -66.19 -35.36 80.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.19 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.8 -47.38 69.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -82.67 -41.28 19.58 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -93.19 9.91 34.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.561 0.696 . . . . 0.0 110.112 -171.666 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -87.03 -47.59 4.68 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 169.886 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -66.7 -42.36 86.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.366 -0.917 . . . . 0.0 110.659 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 C--O 1.246 0.921 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.459 ' HB1' ' CD2' ' A' ' 4' ' ' TYR . . . 70.59 -72.69 0.11 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.675 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m 60.06 26.59 15.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.98 0.419 . . . . 0.0 111.665 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.2 m-85 -68.5 -33.71 74.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.112 0.482 . . . . 0.0 110.458 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.79 -35.07 78.65 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.518 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -74.55 -43.97 53.23 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.138 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.669 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -69.51 -40.96 80.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -174.067 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 7' ' ' ILE . 32.6 tp -102.58 -104.02 0.28 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.011 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.553 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 7.2 m-20 -158.48 -22.65 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.125 -177.223 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.4 m -118.48 158.52 46.74 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.647 -176.586 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.618 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.3 Cg_endo -59.3 -81.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.079 2.519 . . . . 0.0 114.118 -172.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' HD11 ' A' ' 56' ' ' LEU . 37.8 ptt180 -171.32 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -177.393 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.5 t -97.25 27.41 4.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.304 0.573 . . . . 0.0 110.455 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.44 145.92 30.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.497 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.5 m -55.37 128.58 34.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ALA . . . . . 0.599 ' O ' ' HG2' ' A' ' 20' ' ' LYS . . . -53.23 -33.75 54.22 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -170.644 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.75 -34.8 77.95 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.878 0.371 . . . . 0.0 110.753 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.82 -35.81 77.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.754 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.802 HG21 ' HB2' ' A' ' 57' ' ' SER . 2.4 mp -59.72 -42.68 89.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.733 170.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 16' ' ' ALA . 71.0 mmtt -61.22 -37.91 84.72 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.562 175.384 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.604 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.63 -47.44 78.54 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.26 176.749 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 9' ' ' ASP . . . -60.63 -39.57 88.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.136 0.494 . . . . 0.0 110.466 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.528 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -67.57 -50.0 60.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.486 176.684 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtt85 -68.36 -37.78 80.79 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 25' ' ' ARG . 8.4 ttt-85 -62.12 -44.44 96.64 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.973 0.416 . . . . 0.0 110.742 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.635 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.2 ttmm -66.46 -42.34 87.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 110.078 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.99 84.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.293 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -66.86 -37.05 83.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.538 -177.98 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -64.12 -34.82 78.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 0.0 110.925 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 99.1 m95 -106.45 19.3 20.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.288 0.566 . . . . 0.0 110.546 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.512 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.27 152.2 94.38 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.356 -178.427 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.1 Cg_endo -54.81 -30.09 66.01 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.492 2.128 . . . . 0.0 112.074 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.8 -24.38 62.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.899 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.43 -3.42 12.42 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -173.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 29.9 p30 -103.54 140.25 20.88 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.262 0.554 . . . . 0.0 110.458 -176.12 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 55.5 Cg_endo -92.19 -104.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.155 2.57 . . . . 0.0 112.85 -177.863 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -98.12 -7.21 30.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.84 0.352 . . . . 0.0 111.854 -176.445 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -94.34 100.91 12.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 0.0 110.182 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -101.63 -29.54 11.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.52 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.85 -43.6 90.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.227 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -71.02 -37.48 72.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.627 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 30' ' ' TRP . . . -63.5 -43.87 95.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.949 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.577 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 10.2 pt-20 -69.55 -38.94 77.68 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.323 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -59.76 -47.8 84.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.684 0.278 . . . . 0.0 110.949 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 67.1 mmtt -65.09 -35.22 80.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.687 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -67.08 -40.73 87.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.475 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 88.2 mttt -68.36 -46.52 69.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 11.9 pt-20 -67.29 -37.49 83.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.376 -175.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.635 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 14.7 p -71.8 -37.72 63.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.334 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -44.37 94.59 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.336 -178.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.96 -40.92 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.19 0.519 . . . . 0.0 110.603 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.669 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.2 -38.93 60.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.083 -175.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.518 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.5 -35.75 68.23 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.45 -45.55 90.35 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.399 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.745 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 11.1 p -70.23 -41.07 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.738 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.474 HD11 ' HA ' ' A' ' 12' ' ' ARG . 58.4 tp -74.31 -30.93 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' SER . . . . . 0.802 ' HB2' HG21 ' A' ' 19' ' ' ILE . 32.1 t -81.72 -21.17 38.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.731 0.301 . . . . 0.0 110.98 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 20.2 t70 -111.83 124.46 52.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 -174.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -66.93 -32.19 73.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.505 ' O ' HG12 ' A' ' 64' ' ' ILE . 43.0 m-70 -68.39 -41.89 79.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 177.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.745 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 5.9 mptp? -61.51 -36.71 81.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.568 174.349 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 46.8 mmm-85 -59.94 -40.8 90.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.059 0.457 . . . . 0.0 109.842 174.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 44.1 mt-10 -65.22 -40.17 93.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.996 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 60' ' ' HIS . 42.4 mm -64.43 -44.45 97.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.776 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.05 -37.33 87.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.914 0.388 . . . . 0.0 110.501 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.08 -45.09 95.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -88.73 -48.05 7.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -94.64 -9.74 34.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.861 0.362 . . . . 0.0 111.248 -170.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.16 -44.63 97.46 Favored Glycine 0 CA--C 1.506 -0.479 0 N-CA-C 111.198 -0.761 . . . . 0.0 111.198 175.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -66.7 -34.28 77.5 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.25 -0.975 . . . . 0.0 111.559 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.957 -177.569 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.772 0.32 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.68 72.65 0.49 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.047 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m -68.75 3.62 1.83 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.411 0.625 . . . . 0.0 110.793 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.579 ' HA ' HG13 ' A' ' 7' ' ' ILE . 98.7 m-85 -68.79 -23.86 64.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.559 176.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -56.59 -33.01 65.8 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.0 -44.37 61.11 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.411 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.851 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.8 -39.18 67.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.826 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.491 ' N ' HD12 ' A' ' 7' ' ' ILE . 38.4 tp -100.59 -90.56 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 171.1 -16.04 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.513 0.725 . . . . 0.0 109.924 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.98 152.46 56.48 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.975 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -87.59 165.49 7.76 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.907 2.405 . . . . 0.0 112.524 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.808 ' HB3' HD11 ' A' ' 56' ' ' LEU . 11.0 ptm180 -70.15 -3.91 18.98 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.472 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 t -56.02 -33.5 64.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.261 172.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -76.34 146.03 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.423 177.736 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.8 p -63.76 155.81 29.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.231 177.579 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.84 64.11 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -170.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.481 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 21.7 m-20 -62.7 -34.42 77.1 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.979 0.418 . . . . 0.0 111.346 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.401 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 5.2 t70 -62.41 -41.37 98.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.865 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.447 HG23 HD22 ' A' ' 8' ' ' LEU . 1.9 mp -62.61 -39.19 83.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.6 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 90.9 mttt -58.24 -41.29 83.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.251 177.585 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -68.88 -36.01 77.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.509 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.34 -35.96 82.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.23 0.538 . . . . 0.0 110.075 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.698 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -65.67 -43.6 88.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.835 174.56 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -68.22 -38.51 81.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.764 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.418 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 4.0 ptm180 -69.37 -36.7 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.902 0.382 . . . . 0.0 110.488 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 21.2 ttmm -70.92 -42.48 69.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 121.163 0.506 . . . . 0.0 109.769 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.38 -45.82 84.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.946 176.326 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.71 -37.32 83.72 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.936 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -65.63 -31.19 72.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.337 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.555 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 98.6 m95 -105.4 13.37 30.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.069 0.461 . . . . 0.0 111.462 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -82.04 147.75 58.58 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.54 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.56 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 12.2 Cg_endo -54.25 -29.4 56.97 Favored 'Trans proline' 0 N--CA 1.477 0.501 0 C-N-CA 124.27 3.313 . . . . 0.0 113.625 -167.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -64.2 -30.59 71.64 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.105 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -111.56 7.55 20.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.56 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 27.0 t-20 -107.98 140.06 21.28 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.467 -176.811 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 91.4 Cg_endo -78.02 -117.76 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.863 2.375 . . . . 0.0 112.753 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.413 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 2.5 m-20 -97.11 -7.03 33.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.591 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 16.8 m120 -103.59 99.02 8.82 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.206 -173.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -93.06 -25.77 17.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.867 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 7.8 tm-20 -60.85 -44.08 97.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.666 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.591 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 54.7 m-85 -71.97 -37.83 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 175.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.87 -46.21 88.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.641 0.258 . . . . 0.0 111.184 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -69.32 -35.63 76.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 5.1 tttp -58.77 -48.43 81.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.629 177.072 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.434 ' O ' HG12 ' A' ' 49' ' ' VAL . 63.7 mmtt -72.01 -34.99 69.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.911 -178.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.98 -40.19 92.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.243 0.544 . . . . 0.0 109.689 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -67.37 -45.87 75.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.467 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.79 -43.3 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.635 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.698 HG22 ' HD1' ' A' ' 23' ' ' TYR . 12.0 p -67.89 -37.4 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.909 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.73 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.775 0.322 . . . . 0.0 111.263 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.08 -36.85 69.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.078 0.466 . . . . 0.0 110.525 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.851 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.62 -38.53 58.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.091 -173.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -36.08 72.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -65.03 -47.08 78.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.612 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.616 ' HA ' ' CB ' ' A' ' 61' ' ' LYS . 11.8 p -64.68 -38.71 83.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.37 . . . . 0.0 111.145 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 12' ' ' ARG . 48.1 tp -74.08 -29.15 61.72 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.7 t -84.19 -19.55 33.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.495 0.188 . . . . 0.0 111.205 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 23.3 t70 -112.36 129.99 56.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.383 0.611 . . . . 0.0 111.56 -174.606 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.723 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.69 -36.06 81.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.153 -175.425 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.416 ' O ' HD13 ' A' ' 64' ' ' ILE . 35.5 m170 -69.75 -41.89 74.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.128 0.49 . . . . 0.0 110.227 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.809 ' HA ' ' HE2' ' A' ' 61' ' ' LYS . 10.5 mmpt? -61.15 -37.76 84.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.603 176.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 89.0 mtt180 -61.77 -47.22 86.17 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.758 0.313 . . . . 0.0 111.427 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -71.39 -35.8 71.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.611 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.6 mp -65.11 -39.19 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.62 -38.02 83.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.401 . . . . 0.0 110.629 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -73.08 -47.72 42.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.453 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 64' ' ' ILE . 8.6 ptm180 -77.01 -30.93 56.06 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -173.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -94.85 -10.14 32.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.286 0.565 . . . . 0.0 110.053 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.64 -47.27 10.25 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.312 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -62.82 -27.64 69.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.003 -0.598 . . . . 0.0 111.832 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.464 -0.779 . . . . 0.0 111.376 -176.526 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.875 0.369 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.17 138.24 3.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.173 0.511 . . . . 0.0 111.472 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.9 p -72.0 -28.64 63.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.191 173.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.518 ' O ' HG13 ' A' ' 7' ' ' ILE . 57.2 m-85 -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.794 176.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.38 -32.7 73.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.427 176.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -73.36 -44.03 59.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.07 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.5 pp -70.22 -40.54 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.38 -176.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 20.2 tp -102.29 -93.08 0.31 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.049 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' H ' ' H ' ' A' ' 10' ' ' VAL . 4.5 p30 174.27 3.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.021 0.826 . . . . 0.0 110.771 173.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.453 HG22 HD23 ' A' ' 8' ' ' LEU . 17.0 m -121.11 154.39 58.26 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-O 120.643 0.258 . . . . 0.0 110.985 176.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.41 161.7 43.74 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.181 2.587 . . . . 0.0 112.619 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.534 ' HD3' ' N ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -68.6 -20.4 64.5 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.501 -175.083 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.534 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 21.0 m -77.32 -2.51 35.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.328 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.725 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -74.22 143.49 45.11 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.338 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -86.04 173.01 10.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.993 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.23 -39.7 60.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -64.84 -41.16 95.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.338 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.725 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 3.3 m-20 -62.01 -44.12 97.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.248 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.639 HG22 ' HD2' ' A' ' 53' ' ' TYR . 1.9 mp -63.92 -38.67 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.456 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -36.08 80.82 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.798 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.1 mmpt? -64.07 -46.62 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.122 175.65 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.405 ' HB2' HG13 ' A' ' 10' ' ' VAL . . . -63.74 -37.51 87.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 110.591 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.621 ' HA ' HG21 ' A' ' 49' ' ' VAL . 2.7 t80 -63.02 -46.7 86.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.792 175.155 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -67.55 -37.2 82.33 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -176.409 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 25' ' ' ARG . 5.4 ptp180 -67.89 -40.76 83.48 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.177 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.937 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.6 ttmm -70.23 -42.5 72.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.371 0.605 . . . . 0.0 109.56 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.55 -44.7 85.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.399 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.5 -46.25 90.79 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.391 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -63.09 -31.54 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.139 -177.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.716 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 89.1 m95 -106.09 18.89 21.37 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.077 0.465 . . . . 0.0 111.323 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m170 -83.65 143.75 44.46 Favored Pre-proline 0 C--N 1.32 -0.675 0 O-C-N 122.069 -0.395 . . . . 0.0 110.165 173.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.0 -25.92 56.29 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.671 2.914 . . . . 0.0 111.941 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -59.73 -33.63 71.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.21 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -113.68 -29.88 6.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.77 ' ND2' ' HD2' ' A' ' 36' ' ' PRO . 3.3 t-20 -102.44 132.5 21.32 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.77 ' HD2' ' ND2' ' A' ' 35' ' ' ASN . 74.2 Cg_endo -73.61 -115.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.982 2.454 . . . . 0.0 115.699 -167.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.44 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 6.7 m-20 -85.91 -7.2 58.85 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -165.287 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -101.62 98.41 8.71 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.38 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -103.92 -23.13 13.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.767 -176.421 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 21.5 tt0 -66.26 -41.02 90.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.299 0.571 . . . . 0.0 110.601 -178.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.34 -37.46 83.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.83 177.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.716 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.66 -44.39 81.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.029 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 12.9 pt-20 -67.34 -36.46 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.75 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -60.05 -40.85 90.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.715 0.293 . . . . 0.0 110.706 174.331 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 68.2 mmtt -71.84 -35.25 69.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.799 0.333 . . . . 0.0 110.565 177.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.44 -39.33 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.718 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -65.31 -41.72 93.77 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.431 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.28 -43.2 98.6 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.473 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.937 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 6.7 p -70.42 -38.84 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.524 178.132 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HA ' ' HD1' ' A' ' 53' ' ' TYR . . . -61.43 -45.07 95.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.554 0.216 . . . . 0.0 111.58 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.0 pt-20 -71.91 -43.63 65.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.017 0.437 . . . . 0.0 111.032 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.63 67.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.43 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.639 ' HD2' HG22 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -70.63 -33.66 71.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -60.68 -42.31 96.84 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.535 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.775 HG13 ' HG3' ' A' ' 61' ' ' LYS . 64.3 t -69.04 -44.81 80.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.001 0.429 . . . . 0.0 110.566 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.561 ' HG ' HG12 ' A' ' 19' ' ' ILE . 40.3 tp -72.25 -17.48 61.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.323 -175.664 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.8 m -82.83 -18.39 40.61 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 122.043 -0.41 . . . . 0.0 111.922 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -109.01 123.4 49.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.202 0.525 . . . . 0.0 111.482 -175.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -61.08 -38.01 84.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.653 -177.734 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.421 ' O ' HD13 ' A' ' 64' ' ' ILE . 80.6 t60 -65.12 -40.51 94.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.775 ' HG3' HG13 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -70.28 -33.63 71.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.382 177.698 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.74 -47.46 83.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.097 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -71.32 -34.96 71.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.863 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.421 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.5 mp -65.04 -42.5 94.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -65.62 -36.73 84.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.978 0.418 . . . . 0.0 110.225 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.19 -47.84 78.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.661 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.686 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 10.8 ptm180 -88.58 -48.86 7.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -94.3 -10.56 32.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.92 0.391 . . . . 0.0 111.176 -168.426 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.4 -49.32 6.29 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.474 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -67.42 -25.52 65.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.673 -0.763 . . . . 0.0 112.751 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.686 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 75.4 mm-40 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.929 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.97 145.04 2.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.873 0.368 . . . . 0.0 110.795 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m -81.25 -12.92 58.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.807 ' HA ' HG12 ' A' ' 7' ' ' ILE . 66.8 m-85 -68.44 -26.12 65.36 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.67 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.0 -39.31 81.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.667 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -73.51 -44.21 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.847 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.831 HD12 ' HB1' ' A' ' 52' ' ' ALA . 12.4 pt -71.81 -42.31 69.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -172.488 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.511 ' N ' HG13 ' A' ' 7' ' ' ILE . 15.6 mt -103.85 -75.3 0.62 Allowed 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 120.966 0.412 . . . . 0.0 109.937 176.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 168.95 -30.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.514 -174.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.0 m -120.66 154.12 56.98 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.9 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.76 -178.63 4.54 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.994 2.463 . . . . 0.0 112.616 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.85 -17.58 61.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.99 0.424 . . . . 0.0 111.346 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -23.42 66.7 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.562 175.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 145.84 44.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.914 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.2 m -67.63 159.78 29.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.978 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.04 -36.27 60.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.179 0.514 . . . . 0.0 111.223 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -61.5 -40.28 94.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.812 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -62.2 -44.61 96.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.657 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.85 -45.73 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.748 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.5 ttmm -60.83 -40.85 94.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.773 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HD2' ' HA ' ' A' ' 21' ' ' LYS . 9.6 mmmm -70.33 -35.56 73.69 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.92 -41.58 96.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.268 0.556 . . . . 0.0 109.642 173.375 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.54 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -65.47 -44.11 88.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.012 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -61.88 -41.16 97.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.748 0.309 . . . . 0.0 111.629 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -67.48 -44.12 79.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.503 . . . . 0.0 110.952 175.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CG ' ' HB ' ' A' ' 49' ' ' VAL . 3.6 tppp? -60.35 -38.59 84.29 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.311 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.707 ' HA ' ' NE1' ' A' ' 30' ' ' TRP . . . -60.62 -42.13 96.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.995 175.192 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.4 -35.4 73.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.65 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 24.2 mm-40 -60.38 -33.37 72.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.275 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.707 ' NE1' ' HA ' ' A' ' 27' ' ' ALA . 64.1 p-90 -106.46 6.42 30.24 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.626 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.1 m170 -74.2 146.99 85.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.563 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 17.0 Cg_endo -55.67 -28.1 64.3 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.758 2.972 . . . . 0.0 112.687 -176.885 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.82 -24.38 63.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.124 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -119.16 -10.87 9.69 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.563 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -104.44 133.86 19.98 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 92.1 Cg_endo -96.56 -112.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.394 2.73 . . . . 0.0 113.096 -177.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -85.23 -6.75 59.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.61 0.719 . . . . 0.0 110.065 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.769 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 80.9 m-20 -90.66 103.09 15.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.731 -174.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -98.2 -29.32 13.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.091 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 34.1 tt0 -59.71 -44.69 93.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.133 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.769 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 93.4 m-85 -65.04 -37.65 88.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.913 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.25 -44.7 94.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.188 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.04 -37.95 75.72 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.748 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 55.7 mtpt -63.75 -46.29 85.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.616 0.246 . . . . 0.0 110.99 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.617 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 30.1 mmtp -66.55 -34.68 78.44 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.32 -50.89 71.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.077 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HB2' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -69.08 -43.15 75.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.103 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 9.1 pt-20 -64.83 -37.31 87.19 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.971 -175.291 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.54 HG22 ' HD1' ' A' ' 23' ' ' TYR . 13.1 p -72.42 -38.94 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 C-N-CA 120.139 -0.625 . . . . 0.0 110.869 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.33 -45.41 91.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 11.1 pt-20 -72.02 -43.16 65.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.058 -179.17 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.831 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -75.07 -42.48 56.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.177 -173.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 4.1 t80 -70.89 -35.57 72.39 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.215 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.96 -50.46 68.54 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.01 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.543 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.6 p -62.55 -41.3 91.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -175.668 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 tp -75.18 -28.96 60.24 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.1 m -85.9 -19.44 30.53 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.777 0.322 . . . . 0.0 111.043 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -102.51 124.22 47.68 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.593 0.711 . . . . 0.0 110.767 -177.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.677 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 8.0 mptt -68.86 -31.43 70.37 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.154 -175.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.61 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 87.9 m-70 -70.44 -43.83 69.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.187 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -65.08 -34.42 78.38 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 175.127 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 mmm180 -59.25 -41.66 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.625 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.61 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 41.7 mt-10 -60.59 -43.37 97.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.827 0.346 . . . . 0.0 110.799 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.36 -44.93 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -66.18 -35.25 79.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.234 0.54 . . . . 0.0 110.413 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.89 -45.79 87.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.611 -177.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -88.46 -37.56 15.71 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -101.0 9.87 41.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 0.0 111.495 -171.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.77 -56.43 4.15 Favored Glycine 0 CA--C 1.508 -0.369 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.53 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -66.62 -36.63 83.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.154 -0.523 . . . . 0.0 112.064 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.793 -0.623 . . . . 0.0 111.012 -176.734 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.664 0.269 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.18 -48.09 0.36 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.792 0.33 . . . . 0.0 111.079 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.3 p 58.61 0.69 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.487 1.115 . . . . 0.0 113.822 175.747 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.498 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 38.2 m-85 -68.82 -27.05 65.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.176 0.513 . . . . 0.0 110.971 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.563 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 1.3 p90 -66.78 -32.7 74.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.489 173.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.404 ' HG3' ' CD1' ' A' ' 5' ' ' TYR . 37.4 mt-10 -74.25 -43.83 55.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.124 177.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.498 ' CG1' ' HA ' ' A' ' 4' ' ' TYR . 2.5 pp -71.6 -33.21 48.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.781 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG23 ' A' ' 19' ' ' ILE . 54.0 tp -99.36 -79.69 0.48 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.966 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 176.35 -41.02 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.16 -175.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 m -122.99 151.55 61.52 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.197 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.563 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 27.4 Cg_endo -64.37 151.39 85.69 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.137 2.558 . . . . 0.0 112.166 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -73.38 -15.03 61.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.21 -172.014 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.9 m -62.2 -18.88 62.32 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.937 174.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -73.49 145.94 45.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.8 t -66.12 161.7 21.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.458 -177.002 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.5 50.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.202 0.525 . . . . 0.0 110.665 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -60.72 -41.89 96.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.411 178.201 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 10.5 m-20 -68.28 -41.24 81.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.497 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.616 HG22 ' HD1' ' A' ' 53' ' ' TYR . 1.7 mp -60.77 -42.85 93.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.932 174.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -62.0 -40.86 97.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.409 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.5 mmpt? -63.08 -40.97 99.24 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.4 176.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -60.45 -46.13 91.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.096 0.474 . . . . 0.0 110.258 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.476 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -61.94 -48.59 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.8 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.95 78.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.461 HH11 ' HD3' ' A' ' 25' ' ' ARG . 18.6 ttt-85 -60.58 -44.06 96.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.997 177.676 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.65 ' HD2' HG21 ' A' ' 49' ' ' VAL . 58.4 mttm -67.72 -37.19 81.9 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.267 0.556 . . . . 0.0 109.922 177.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.48 75.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.708 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 3.5 mm? -71.89 -35.78 69.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.01 0.433 . . . . 0.0 111.047 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.01 -38.78 89.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.847 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -109.61 20.69 17.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.348 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.48 ' HB2' ' HA ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -69.29 145.69 96.07 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.382 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 10.5 Cg_endo -53.52 -34.34 72.0 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 122.355 2.037 . . . . 0.0 113.098 -168.528 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.91 -24.17 63.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.072 0.463 . . . . 0.0 110.969 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -113.87 7.89 17.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.99 145.77 31.19 Favored Pre-proline 0 C--O 1.234 0.286 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.058 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 84.0 Cg_endo -81.44 -120.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.941 2.428 . . . . 0.0 112.949 -174.012 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.439 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 5.2 m-20 -97.11 -8.15 30.91 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.866 0.365 . . . . 0.0 111.218 -176.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -98.61 100.63 11.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.951 0.405 . . . . 0.0 110.26 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 13.8 mptt -92.61 -30.67 15.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.314 175.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 15.5 tp10 -60.84 -43.94 97.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.897 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -72.32 -38.29 68.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.586 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.32 90.83 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 11.2 pt-20 -71.22 -37.76 72.04 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.907 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 20.6 tptp -61.12 -45.96 92.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.549 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' O ' HG12 ' A' ' 49' ' ' VAL . 31.9 mmtp -65.96 -38.14 87.82 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.995 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -62.15 -40.08 94.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.653 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.4 mmtt -66.74 -41.77 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.856 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.32 -44.12 92.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.001 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 ' HD2' ' A' ' 26' ' ' LYS . 7.3 p -72.03 -38.28 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.007 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.08 95.6 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.213 -0.195 . . . . 0.0 111.37 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 10.7 pt-20 -72.05 -40.27 68.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.0 110.728 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 51' ' ' GLU . . . -72.39 -38.96 68.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.633 -174.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.84 -40.48 72.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -62.12 -49.88 74.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.012 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.02 -38.08 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 111.306 -177.49 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.0 tp -72.99 -26.26 61.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.772 0.32 . . . . 0.0 111.418 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -82.06 -18.8 41.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.674 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.483 ' HB3' ' HB2' ' A' ' 61' ' ' LYS . 17.6 t70 -110.35 122.2 47.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 0.0 110.318 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -66.35 -34.33 77.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.427 -174.833 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 33.6 t60 -71.97 -40.51 68.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.13 -34.32 77.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.972 177.339 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 66' ' ' ASP . 0.8 OUTLIER -60.15 -42.56 95.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.788 173.805 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.507 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 38.4 mt-10 -61.05 -44.71 96.98 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.176 0.512 . . . . 0.0 110.107 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 48.7 mm -68.82 -46.09 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.804 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -64.5 -35.91 82.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -177.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -70.32 -45.66 65.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.088 -174.241 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.582 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 9.1 ptm180 -85.61 -27.48 25.43 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.742 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.4 9.93 29.66 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.806 0.812 . . . . 0.0 109.792 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.82 -50.4 3.11 Favored Glycine 0 N--CA 1.442 -0.904 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.17 172.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -65.16 -46.92 78.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.755 -0.723 . . . . 0.0 111.812 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 9.5 pt-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.413 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.83 0.347 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.472 ' HB1' ' HD2' ' A' ' 4' ' ' TYR . . . -171.05 -49.7 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.9 t 69.34 -6.56 0.94 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.941 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.581 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 85.1 m-85 -62.54 -29.86 70.87 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.86 0.362 . . . . 0.0 111.52 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -34.78 78.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.914 0.388 . . . . 0.0 110.758 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -75.45 -43.87 47.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.899 176.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.613 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -67.82 -38.37 80.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.882 0.372 . . . . 0.0 111.039 -177.234 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.1 tp -101.01 -93.97 0.28 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 175.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.494 ' OD1' HG13 ' A' ' 10' ' ' VAL . 4.5 p30 -178.72 -19.87 0.0 OUTLIER 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.58 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.494 HG13 ' OD1' ' A' ' 9' ' ' ASP . 16.2 m -118.74 150.9 49.24 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.984 0.421 . . . . 0.0 110.768 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -94.85 -178.12 0.53 Allowed 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 123.405 2.737 . . . . 0.0 112.982 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.3 ptt85 -64.66 -27.56 69.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.682 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.8 p -63.3 -20.49 65.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.448 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.33 146.98 31.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.54 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.6 t -50.56 141.68 12.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.137 175.286 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.64 -31.92 64.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.004 0.43 . . . . 0.0 110.699 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.489 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 7.3 m-20 -65.91 -34.61 78.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.766 174.351 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.42 -43.26 77.57 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.222 178.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.537 HG12 ' CD1' ' A' ' 56' ' ' LEU . 2.0 mp -60.26 -38.95 79.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.35 0.595 . . . . 0.0 109.862 173.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -65.32 -34.72 79.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.912 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.81 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.37 -43.23 95.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 173.606 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.79 93.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.105 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -62.09 -42.65 99.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.135 176.314 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -66.83 -43.6 83.31 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.523 -177.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -70.15 -32.2 70.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.127 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -61.17 -43.47 98.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.423 0.63 . . . . 0.0 109.973 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.79 71.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.96 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.405 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.7 mp -68.37 -36.53 79.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.868 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -62.17 -39.57 93.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.885 0.374 . . . . 0.0 111.153 -178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -108.42 18.77 20.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.326 0.584 . . . . 0.0 110.614 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.506 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 14.2 t-80 -71.86 139.32 82.87 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.965 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.506 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 14.7 Cg_endo -55.97 -32.22 84.96 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 123.912 3.075 . . . . 0.0 114.424 -170.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.66 -28.92 65.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.794 0.33 . . . . 0.0 110.605 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.27 9.73 41.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.9 t-20 -104.5 134.28 19.75 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.8 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.73 -110.17 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.824 2.35 . . . . 0.0 113.489 -177.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -97.67 -11.59 23.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.139 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -107.89 101.29 10.58 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.874 -176.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -98.94 -18.98 17.56 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.17 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -59.42 -47.61 84.82 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.416 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.9 p90 -72.06 -36.54 69.61 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.238 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.9 94.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.367 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HG3' ' HD2' ' A' ' 44' ' ' LYS . 6.7 pt-20 -68.9 -38.77 79.82 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.885 -178.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD2' ' HG3' ' A' ' 43' ' ' GLU . 12.7 mptt -68.61 -36.55 78.82 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.04 176.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 66.8 mmtt -64.71 -33.34 75.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -68.92 -39.94 79.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.328 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -62.59 -47.8 82.2 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.108 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 7.1 pt-20 -65.87 -44.08 86.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.314 -176.625 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 7.7 p -65.58 -38.34 82.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.237 -0.585 . . . . 0.0 111.144 -177.477 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.85 82.19 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.903 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -74.0 -41.31 62.08 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.157 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -74.44 -35.95 63.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.922 -173.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -69.18 -42.72 75.47 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 176.638 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -57.95 -48.49 79.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.809 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 52' ' ' ALA . 11.2 p -69.68 -41.64 80.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.598 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.731 HD22 ' HD3' ' A' ' 62' ' ' ARG . 2.9 tm? -73.91 -30.27 62.49 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.1 t -78.96 -17.57 55.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.153 -0.342 . . . . 0.0 110.861 -176.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.491 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 22.0 t70 -112.44 127.53 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.321 0.581 . . . . 0.0 110.504 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.41 -36.36 82.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.293 -175.33 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.51 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 73.6 t60 -68.37 -40.56 81.41 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.491 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 74.9 mmtt -61.17 -43.18 99.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.549 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.731 ' HD3' HD22 ' A' ' 56' ' ' LEU . 50.6 mtm105 -60.45 -45.08 94.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 178.301 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -60.9 -39.91 91.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.622 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.477 HG12 ' O ' ' A' ' 60' ' ' HIS . 33.8 mm -65.2 -44.26 95.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.078 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -61.59 -38.49 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.061 0.458 . . . . 0.0 110.516 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -64.99 -46.36 81.79 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.421 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.425 ' HD3' HD13 ' A' ' 64' ' ' ILE . 11.7 ptm180 -81.4 -28.44 34.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -176.714 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -93.49 -8.61 41.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.86 0.362 . . . . 0.0 110.799 -174.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -52.42 -50.53 47.24 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.703 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.07 -28.24 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.181 -0.509 . . . . 0.0 112.111 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.056 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.705 ' HA ' ' HE2' ' A' ' 65' ' ' TYR . . . -110.62 -34.76 6.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.409 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.1 m 59.16 29.37 18.91 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 121.343 0.592 . . . . 0.0 110.307 -173.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.831 ' HA ' HG12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -69.17 -38.01 78.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.293 -172.888 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.6 p90 -61.28 -33.27 73.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.147 173.449 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HG2' ' CE2' ' A' ' 5' ' ' TYR . 4.5 mt-10 -75.37 -44.21 46.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.626 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.831 HG12 ' HA ' ' A' ' 4' ' ' TYR . 11.0 pt -70.5 -40.33 77.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -169.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.486 HD13 HG23 ' A' ' 19' ' ' ILE . 18.5 mt -93.34 -75.61 0.49 Allowed 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.319 -176.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.0 t70 171.58 -24.48 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 O-C-N 124.338 1.024 . . . . 0.0 110.779 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 31.4 m -118.61 150.88 49.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.593 -170.147 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -91.36 -179.78 1.44 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.534 2.823 . . . . 0.0 113.067 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.658 ' HA ' ' HE2' ' A' ' 4' ' ' TYR . 32.9 mtm180 -60.14 -15.16 21.4 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.459 -167.324 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -82.18 -6.82 59.48 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.06 135.39 35.82 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.103 0.478 . . . . 0.0 111.044 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 t -81.05 166.11 21.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.619 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.31 -43.75 64.68 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -172.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 1.3 m-20 -65.74 -33.45 75.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.534 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -67.68 -40.49 84.41 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.486 HG23 HD13 ' A' ' 8' ' ' LEU . 1.8 mp -60.68 -41.52 88.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.056 173.351 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 36.4 ttmt -55.74 -43.71 76.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.18 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -69.37 -35.66 76.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.225 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.511 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -60.45 -42.51 96.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.082 0.468 . . . . 0.0 110.472 177.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.666 ' HD1' HG22 ' A' ' 49' ' ' VAL . 3.4 t80 -63.22 -43.23 98.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.864 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.406 ' O ' HD13 ' A' ' 28' ' ' LEU . 70.9 mtp180 -68.31 -44.17 76.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 10.1 ptm180 -66.1 -33.52 75.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.04 0.448 . . . . 0.0 110.492 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.622 ' HD3' ' HB ' ' A' ' 49' ' ' VAL . 35.7 tttp -70.42 -43.59 69.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.556 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.48 -47.74 81.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.566 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 24' ' ' ARG . 7.4 mp -62.88 -37.59 87.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.336 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.73 -30.17 71.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.975 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.591 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 59.1 m95 -108.46 17.56 21.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 111.479 -178.102 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -83.19 152.32 64.7 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 171.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -54.9 -27.04 51.63 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.845 3.03 . . . . 0.0 112.862 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.51 -34.79 77.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.36 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.14 -31.88 8.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.022 0.439 . . . . 0.0 111.554 -177.591 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -103.9 135.0 19.42 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 72.0 Cg_endo -71.12 -119.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.82 2.347 . . . . 0.0 114.589 -169.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.443 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 34.7 t70 -94.29 -7.65 41.3 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -167.194 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -93.55 101.64 13.82 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -94.52 -26.88 16.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -173.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.13 -46.51 88.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.273 -175.227 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.466 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 18.9 m-85 -72.96 -38.5 66.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.591 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.47 -46.15 89.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 3.1 pt-20 -70.29 -36.04 74.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.354 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.621 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 12.1 mmmt -58.83 -44.64 90.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.875 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 30.6 mmtp -66.84 -35.35 79.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.075 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -64.16 -40.25 95.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.296 174.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -67.01 -36.52 82.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.99 176.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 43.4 mm-40 -63.29 -44.69 94.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.014 0.435 . . . . 0.0 110.417 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.666 HG22 ' HD1' ' A' ' 23' ' ' TYR . 3.2 p -72.73 -37.38 55.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.92 177.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.62 -44.94 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.475 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.16 -42.85 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.05 0.453 . . . . 0.0 111.244 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.619 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -71.47 -34.84 70.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.392 0.615 . . . . 0.0 111.552 -176.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 28.0 t80 -71.58 -34.7 70.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.932 175.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.03 -49.99 75.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.119 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.836 HG23 ' HG3' ' A' ' 61' ' ' LYS . 7.1 p -65.18 -38.52 82.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.338 . . . . 0.0 110.737 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 56' ' ' LEU . 0.8 OUTLIER -73.73 -18.49 60.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.983 0.421 . . . . 0.0 110.96 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 t -78.27 -22.81 47.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.01 -174.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -112.15 124.56 52.7 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.15 -35.84 81.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.297 0.57 . . . . 0.0 110.98 -172.86 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.622 ' O ' HG12 ' A' ' 64' ' ' ILE . 48.9 t60 -70.6 -41.4 72.36 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.126 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.836 ' HG3' HG23 ' A' ' 55' ' ' VAL . 3.7 tppp? -61.87 -36.35 81.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.523 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -58.86 -46.55 87.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.516 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.1 pt-20 -71.71 -33.96 69.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.693 0.282 . . . . 0.0 110.343 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 60' ' ' HIS . 48.9 mm -64.51 -44.68 96.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 CA-C-O 121.129 0.49 . . . . 0.0 109.704 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.705 ' HE2' ' HA ' ' A' ' 2' ' ' ALA . 60.1 t80 -58.63 -41.99 87.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.874 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -72.85 -45.91 55.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.797 -175.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 -86.72 -29.31 22.5 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -174.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -94.68 -7.23 41.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.126 0.489 . . . . 0.0 110.201 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 -37.45 94.55 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -60.7 -26.41 67.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.923 -1.138 . . . . 0.0 111.701 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.764 179.462 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.945 0.403 . . . . 0.0 109.945 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.455 ' C ' ' H ' ' A' ' 4' ' ' TYR . . . -83.61 74.85 10.09 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 5' ' ' TYR . 3.1 m -73.72 33.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.065 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.618 ' O ' HG13 ' A' ' 7' ' ' ILE . 60.2 m-85 -68.31 -24.58 64.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.694 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.515 ' CD1' ' HG2' ' A' ' 6' ' ' GLU . 4.3 p90 -57.63 -32.73 67.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.766 173.315 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 9.1 mm-40 -73.59 -44.32 57.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.021 0.438 . . . . 0.0 110.929 178.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.3 pp -71.11 -31.02 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.751 -174.972 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.418 HD21 HG23 ' A' ' 19' ' ' ILE . 61.1 tp -97.66 -79.94 0.46 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.601 -179.153 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.637 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 25.1 t70 174.73 -40.56 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 30.1 m -121.72 157.49 56.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.527 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 5.9 Cg_exo -78.34 159.82 29.35 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.388 2.725 . . . . 0.0 112.486 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -62.44 -22.55 66.29 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.646 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -65.71 -17.97 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.277 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.98 146.46 43.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.819 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.8 t -59.61 156.67 13.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -178.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.07 -42.35 63.11 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -174.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -62.89 -34.57 77.68 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.71 -44.13 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.621 0.248 . . . . 0.0 111.112 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.418 HG23 HD21 ' A' ' 8' ' ' LEU . 2.0 mp -60.2 -44.61 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.338 0.589 . . . . 0.0 109.979 175.681 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -65.43 -36.98 85.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.471 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.829 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.076 176.761 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.54 -44.21 96.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.892 0.377 . . . . 0.0 110.756 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 1.1 t80 -57.98 -49.39 76.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.686 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 24' ' ' ARG . 25.9 mtp180 -68.0 -32.68 73.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.706 0.288 . . . . 0.0 111.176 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 22.3 ttm180 -63.75 -46.62 84.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.304 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -70.96 -40.85 71.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.067 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.27 -37.2 66.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.422 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -70.5 -36.86 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.473 178.606 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 13.1 mm-40 -63.31 -35.63 81.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.079 0.466 . . . . 0.0 110.616 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.437 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 29.4 m95 -105.75 19.0 21.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.651 -177.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.533 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.2 t-80 -72.3 141.41 83.34 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.533 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 13.4 Cg_endo -55.2 -31.06 74.37 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.844 3.029 . . . . 0.0 114.205 -168.036 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -70.61 -34.48 72.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.025 0.44 . . . . 0.0 111.183 177.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -90.26 -0.74 57.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.326 0.584 . . . . 0.0 110.08 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 26.8 t-20 -103.2 141.83 23.3 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.54 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 88.4 Cg_endo -74.89 -120.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.427 2.085 . . . . 0.0 112.695 -177.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.428 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 11.9 m-20 -100.15 -8.23 23.9 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -176.731 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -104.9 100.94 10.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.972 0.415 . . . . 0.0 110.467 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -96.88 -17.87 19.88 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.268 -177.622 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.453 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 6.6 tp10 -53.4 -46.93 69.91 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.451 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -73.47 -36.73 65.89 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.17 -45.78 91.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.742 0.306 . . . . 0.0 111.231 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 9.4 pt-20 -69.59 -37.64 77.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.496 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.644 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -60.56 -45.77 92.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.162 178.537 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -66.03 -39.28 90.06 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.281 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -59.04 -40.33 84.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.213 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.13 -40.97 82.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.716 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 13.4 mm-40 -63.64 -44.59 93.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.999 -176.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.61 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.3 p -72.26 -37.76 59.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.791 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.94 92.59 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.41 -38.85 68.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.981 0.42 . . . . 0.0 110.871 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.38 -36.95 71.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.666 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.77 -36.98 67.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.08 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.23 -47.49 85.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.571 HG23 ' HB3' ' A' ' 61' ' ' LYS . 9.0 p -69.78 -38.12 75.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.091 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.479 ' CD1' ' HB3' ' A' ' 4' ' ' TYR . 8.2 tt -71.59 -29.34 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -173.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -78.86 -19.38 52.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.669 0.271 . . . . 0.0 111.514 -174.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.483 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 21.7 t70 -113.13 133.38 55.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.292 0.568 . . . . 0.0 111.415 -176.487 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.536 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.96 -34.47 78.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.853 -177.769 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.448 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.3 m80 -68.96 -44.43 72.97 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.176 0.512 . . . . 0.0 110.124 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.571 ' HB3' HG23 ' A' ' 55' ' ' VAL . 14.1 mmmm -65.01 -37.94 89.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.566 -176.604 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 27.7 mtm180 -66.16 -45.58 80.44 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 -177.201 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 9.7 pt-20 -71.76 -32.71 67.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.893 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.605 HD13 ' HD3' ' A' ' 67' ' ' ARG . 30.1 mm -66.84 -36.01 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -63.18 -36.2 82.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.44 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -45.7 79.93 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.582 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.605 ' HD3' HD13 ' A' ' 64' ' ' ILE . 10.2 ptm180 -83.93 -47.13 11.35 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -94.65 -9.61 34.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.91 0.386 . . . . 0.0 111.239 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.59 -53.06 4.48 Favored Glycine 0 CA--C 1.507 -0.425 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.982 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 mmm-85 -61.18 -27.04 68.13 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.05 -0.575 . . . . 0.0 112.197 -177.503 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.614 -0.708 . . . . 0.0 110.609 -179.02 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.9 mtm . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.066 0.46 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.414 ' CB ' ' HD2' ' A' ' 12' ' ' ARG . . . -157.4 103.19 1.95 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.41 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' SER . . . . . 0.451 ' O ' HG23 ' A' ' 7' ' ' ILE . 15.8 m -81.47 31.36 0.34 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.083 0.468 . . . . 0.0 110.944 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.696 ' OH ' HG12 ' A' ' 19' ' ' ILE . 1.0 OUTLIER -63.59 -37.37 87.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.087 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -67.5 -31.92 72.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.389 . . . . 0.0 110.677 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -73.23 -44.35 59.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.392 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.802 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.5 pp -70.43 -39.12 76.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.315 -175.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 ' HB3' ' A' ' 22' ' ' ALA . 38.0 tp -101.47 -82.27 0.47 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.12 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.9 t70 174.08 -29.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.029 -175.747 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -119.56 155.44 54.35 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.098 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.19 -177.63 3.97 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.032 2.488 . . . . 0.0 112.656 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' HD2' ' CB ' ' A' ' 2' ' ' ALA . 53.7 mtp180 -78.64 -9.37 59.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.846 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -74.3 -9.0 58.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.55 144.22 28.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.638 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.4 m -80.8 167.67 19.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.749 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.91 -43.11 65.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.679 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.42 -35.86 78.73 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.166 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.548 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 41.1 t0 -70.22 -43.76 69.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.306 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.696 HG12 ' OH ' ' A' ' 4' ' ' TYR . 1.2 mp -61.12 -41.76 90.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.743 175.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 58.0 mttm -55.6 -45.9 77.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.001 173.587 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -35.01 79.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.502 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.676 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -66.36 -43.9 84.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.842 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 3.4 p90 -66.43 -37.15 84.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.966 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 24' ' ' ARG . 26.5 mtp180 -57.2 -44.81 83.99 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 123.153 0.283 . . . . 0.0 111.164 177.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 7.2 ptm180 -67.3 -34.43 77.37 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.103 0.478 . . . . 0.0 110.427 -177.702 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -67.54 -38.42 84.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.121 175.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.529 ' HA ' ' CE2' ' A' ' 30' ' ' TRP . . . -55.49 -40.64 71.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.306 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 28' ' ' LEU . 1.7 mm? -66.6 -35.9 81.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.055 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -62.39 -34.78 77.39 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.529 ' CE2' ' HA ' ' A' ' 27' ' ' ALA . 47.4 p-90 -105.14 12.27 32.22 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 110.745 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.611 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 16.4 t-80 -72.19 142.21 84.53 Favored Pre-proline 0 C--N 1.321 -0.662 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 15.0 Cg_endo -54.44 -27.95 51.9 Favored 'Trans proline' 0 N--CA 1.482 0.797 0 C-N-CA 124.111 3.207 . . . . 0.0 114.616 -168.584 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -70.65 -29.84 66.29 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.902 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -91.69 -46.15 8.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.883 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.456 ' O ' ' HA ' ' A' ' 32' ' ' PRO . 67.2 t30 -103.42 129.12 26.05 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 41.6 Cg_endo -91.1 -101.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.577 2.185 . . . . 0.0 115.103 -167.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -86.32 -8.56 57.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.821 0.343 . . . . 0.0 111.84 -168.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -94.85 99.9 11.88 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.828 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 0.9 OUTLIER -93.91 -18.38 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.964 178.866 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 8.5 tp10 -54.95 -46.12 74.96 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.121 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -72.14 -40.77 67.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.76 177.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HA ' ' HB2' ' A' ' 30' ' ' TRP . . . -62.38 -45.97 90.73 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.225 -174.556 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.0 pt-20 -71.71 -37.22 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.995 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -65.96 -40.29 91.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.671 -177.938 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 49' ' ' VAL . 67.1 mmtt -69.28 -35.31 75.91 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.258 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -59.24 -42.65 91.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.949 173.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -66.77 -42.84 85.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.763 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.28 -44.45 95.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.244 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 8.3 p -72.59 -37.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.304 -178.064 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -61.4 -45.94 92.24 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.14 -176.636 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 55' ' ' VAL . 13.2 pt-20 -72.15 -43.23 64.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.021 0.439 . . . . 0.0 110.897 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.802 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.5 -38.95 68.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.86 -173.435 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.572 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -70.99 -42.6 69.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.8 OUTLIER -58.64 -49.73 76.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.483 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.649 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.3 p -70.06 -45.17 77.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-N 116.343 -0.389 . . . . 0.0 112.003 -178.267 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.916 HD23 ' HD3' ' A' ' 62' ' ' ARG . 12.4 mt -74.87 -29.69 61.09 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.5 t -80.09 -18.36 50.17 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.682 -177.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -111.91 127.45 55.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.646 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -69.19 -28.85 66.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.235 -173.466 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' HG12 ' A' ' 64' ' ' ILE . 49.6 m80 -68.63 -43.17 76.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.46 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.649 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.8 OUTLIER -70.25 -38.26 75.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.481 -178.922 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.916 ' HD3' HD23 ' A' ' 56' ' ' LEU . 12.2 mmm180 -58.15 -38.19 76.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.968 175.483 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.447 ' O ' ' HD2' ' A' ' 67' ' ' ARG . 6.1 mm-40 -66.19 -42.91 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.383 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 60' ' ' HIS . 41.5 mm -64.01 -44.29 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.773 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HB2' HG21 ' A' ' 55' ' ' VAL . 52.0 t80 -67.08 -37.37 83.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.881 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -73.17 -46.3 51.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.024 0.44 . . . . 0.0 111.443 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 63' ' ' GLU . 4.1 ptm85 -81.28 -44.09 18.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.619 -173.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -94.89 -10.46 31.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -70.07 -49.56 33.41 Favored Glycine 0 CA--C 1.505 -0.57 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.649 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -65.2 -25.37 67.68 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.958 -0.621 . . . . 0.0 111.943 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 28.1 mm-40 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.042 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.72 -63.66 0.38 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.675 0.79 . . . . 0.0 111.624 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.8 m 65.83 -4.04 0.67 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.466 0.707 . . . . 0.0 112.632 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.575 ' O ' HG13 ' A' ' 7' ' ' ILE . 45.9 m-85 -68.37 -28.88 67.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.948 0.404 . . . . 0.0 111.114 -176.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -64.22 -32.46 74.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.006 0.432 . . . . 0.0 110.771 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.03 -43.84 51.32 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.313 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.4 pp -70.36 -37.83 72.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.34 -174.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -100.72 -84.62 0.43 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.8 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.818 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 31.8 t70 176.35 -33.24 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.426 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.3 m -119.99 156.77 54.16 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.145 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 86.6 Cg_endo -78.54 -177.49 3.93 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.92 2.413 . . . . 0.0 112.888 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -77.53 -21.78 52.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.041 0.448 . . . . 0.0 111.126 -178.004 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -78.76 1.79 21.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.582 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.57 145.79 27.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 0.0 110.737 177.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.1 t -70.51 160.84 31.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.79 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.43 -42.7 64.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 0.0 111.667 -174.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -61.62 -35.66 78.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.545 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -63.27 -45.77 89.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.4 HG12 ' CD2' ' A' ' 56' ' ' LEU . 2.0 mp -62.38 -45.63 98.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.339 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.71 -39.91 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.773 0.32 . . . . 0.0 111.0 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.776 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.91 -42.15 81.58 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 177.289 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.818 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.78 -43.48 98.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.958 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -62.16 -47.87 82.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.777 178.704 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.555 ' HG3' ' CE2' ' A' ' 23' ' ' TYR . 88.8 mtt180 -69.29 -39.32 78.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 5.0 ptp180 -63.0 -38.17 90.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.632 178.095 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HG3' ' HZ3' ' A' ' 30' ' ' TRP . 65.6 tttm -69.41 -40.75 77.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.221 0.534 . . . . 0.0 110.042 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.57 94.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.597 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.4 mp -71.56 -37.2 71.11 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -67.84 -28.59 67.69 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.608 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 12.5 m-90 -109.01 18.62 20.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.551 0.691 . . . . 0.0 110.698 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.498 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 52.6 t-80 -74.06 142.87 79.84 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 172.639 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.765 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 11.3 Cg_endo -54.29 -28.92 55.07 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.504 2.802 . . . . 0.0 113.343 -173.679 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.45 -23.76 63.71 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.251 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -122.51 18.23 10.47 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.765 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -102.27 145.83 31.22 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.536 -175.701 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -81.79 -110.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 122.997 2.464 . . . . 0.0 113.421 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -93.48 -11.68 31.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.774 0.321 . . . . 0.0 111.524 -174.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 41' ' ' PHE . 7.3 p30 -106.92 114.71 28.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.95 0.405 . . . . 0.0 111.036 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 5.5 mptt -103.86 -32.3 9.36 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.59 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -66.93 -43.99 81.81 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.496 177.96 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.469 ' HB2' ' HB2' ' A' ' 38' ' ' ASN . 75.0 m-85 -72.33 -37.39 68.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.095 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -61.46 -45.41 94.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.795 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -67.65 -35.77 79.51 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.146 176.742 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.603 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -61.93 -40.87 97.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.467 177.709 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -63.87 -34.6 78.31 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.193 0.52 . . . . 0.0 109.666 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.77 -41.8 87.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.042 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -57.68 -44.9 86.12 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 44' ' ' LYS . 50.8 mt-10 -63.01 -45.6 91.59 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.054 0.454 . . . . 0.0 110.277 -177.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.616 HG22 ' HD1' ' A' ' 23' ' ' TYR . 9.7 p -70.88 -37.18 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.126 -172.599 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -63.9 -45.56 88.78 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.041 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -72.66 -41.81 65.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.066 0.46 . . . . 0.0 110.747 -179.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.548 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -73.14 -43.66 61.25 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.996 -174.341 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.477 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -66.97 -35.38 79.84 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.837 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 13.5 tp10 -60.73 -50.78 72.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.607 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.818 ' HA ' ' HD2' ' A' ' 61' ' ' LYS . 10.0 p -71.35 -39.55 72.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.582 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.436 HD23 ' O ' ' A' ' 56' ' ' LEU . 9.4 tt -72.83 -28.9 62.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -173.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -78.0 -15.33 59.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.409 -175.139 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 30.5 t70 -112.15 121.46 45.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.502 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -61.67 -34.33 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.549 -175.351 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -69.76 -44.5 70.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.776 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.818 ' HD2' ' HA ' ' A' ' 55' ' ' VAL . 22.8 ttmm -71.01 -43.37 68.1 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.915 -174.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 27.1 ptt180 -67.57 -38.57 84.3 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.511 -177.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 8.9 pt-20 -72.68 -36.39 67.88 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.498 177.6 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.91 -39.36 85.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.61 -35.32 80.63 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.007 0.432 . . . . 0.0 110.33 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -72.8 -48.9 34.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.896 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.23 -42.13 11.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -95.04 -10.67 30.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 0.0 110.359 -170.382 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.14 -46.58 93.69 Favored Glycine 0 CA--C 1.505 -0.54 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.695 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -61.9 -26.67 68.31 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.451 -0.874 . . . . 0.0 111.903 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.419 -177.566 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -131.75 144.2 50.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.331 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.0 m -63.53 -8.19 8.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.983 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.736 ' HA ' HG12 ' A' ' 7' ' ' ILE . 34.1 m-85 -63.09 -28.06 69.82 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.296 0.57 . . . . 0.0 109.823 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -61.26 -37.62 83.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.205 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -74.0 -42.6 60.13 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.132 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.853 HD12 ' HB1' ' A' ' 52' ' ' ALA . 11.2 pt -70.98 -41.99 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.697 -172.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.55 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 15.6 mt -102.83 -74.82 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.015 0.436 . . . . 0.0 110.312 178.004 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.4 t70 172.07 -31.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.804 -173.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 25.1 m -120.98 150.62 53.59 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.831 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 10' ' ' VAL . 7.6 Cg_endo -87.5 -172.2 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.247 2.632 . . . . 0.0 112.968 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.497 ' HB3' ' CD2' ' A' ' 4' ' ' TYR . 15.7 ptm180 -68.31 -21.29 64.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.717 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p -67.94 -15.96 63.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.979 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.05 144.21 29.23 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.084 176.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 p -72.97 148.17 44.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.136 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.2 -31.08 41.14 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -167.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 2.9 m-20 -65.71 -35.27 80.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.37 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.39 -37.33 82.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.487 0.66 . . . . 0.0 109.433 176.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.428 HG23 HD13 ' A' ' 8' ' ' LEU . 1.7 mp -60.31 -46.78 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.2 175.637 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 17' ' ' ASP . 21.1 pttm -66.01 -33.86 76.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.004 0.431 . . . . 0.0 110.359 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 7.8 tptm -66.71 -41.63 87.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.377 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -61.68 -40.16 93.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.476 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -42.18 81.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.762 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -64.92 -38.18 90.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.991 0.424 . . . . 0.0 110.899 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -67.3 -44.38 79.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 22' ' ' ALA . 26.1 mtpp -62.83 -38.86 92.43 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.065 0.459 . . . . 0.0 109.804 176.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.17 -46.16 75.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.881 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.6 -36.93 73.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.038 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -62.07 -39.82 93.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.535 -176.274 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.533 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 96.6 m95 -109.02 18.03 21.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.87 0.367 . . . . 0.0 111.87 -176.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.61 145.66 71.72 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 170.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 14.8 Cg_endo -55.27 -28.42 62.13 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.02 3.147 . . . . 0.0 113.695 -170.381 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.48 -29.26 69.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.958 0.408 . . . . 0.0 111.023 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -108.44 14.83 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.087 0.47 . . . . 0.0 110.329 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.572 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 28.6 t-20 -115.33 134.46 22.58 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -89.04 -107.81 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.838 2.359 . . . . 0.0 113.61 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.73 -10.22 23.45 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ASN . . . . . 0.485 ' HB3' ' HD1' ' A' ' 41' ' ' PHE . 88.0 m-20 -106.39 100.6 10.12 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.058 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -91.44 -28.66 17.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.315 -0.402 . . . . 0.0 109.993 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -56.4 -43.94 79.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.565 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 83.8 m-85 -66.99 -37.86 84.99 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.691 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.533 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.46 -44.95 81.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.347 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -69.36 -37.96 77.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.594 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.737 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 9.2 mtpm? -65.28 -46.1 81.81 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.719 176.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -64.61 -34.51 78.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.472 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.74 -40.86 98.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.661 174.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.419 ' HE3' ' OE2' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -70.1 -33.94 72.49 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.435 176.202 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.737 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 17.3 mm-40 -63.8 -45.54 89.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 110.616 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.08 -36.13 61.78 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.181 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.67 -46.57 81.05 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.181 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 11.5 pt-20 -73.3 -43.54 60.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.109 0.481 . . . . 0.0 110.807 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.853 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -70.3 -38.92 75.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.718 -173.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -72.37 -37.82 68.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.308 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.16 -50.35 73.54 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.18 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.9 p -65.81 -42.74 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.0 tp -74.35 -29.24 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.6 t -79.74 -14.73 58.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.82 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.671 ' HB3' ' HD3' ' A' ' 61' ' ' LYS . 38.5 m-20 -109.68 121.37 45.06 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -66.03 -34.98 79.32 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.825 -173.154 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HA ' ' OE2' ' A' ' 63' ' ' GLU . 64.8 t60 -71.93 -38.13 69.9 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.337 177.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HD3' ' HB3' ' A' ' 58' ' ' ASP . 1.8 mptm? -68.69 -45.06 72.65 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.777 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HE ' ' HB2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -68.03 -33.91 75.49 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.457 -178.119 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.555 ' OE2' ' HA ' ' A' ' 60' ' ' HIS . 15.8 pt-20 -69.65 -37.0 76.59 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.552 -0.459 . . . . 0.0 109.835 177.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.0 mm -66.31 -44.09 91.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.062 175.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.61 -34.43 76.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.804 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.19 -47.13 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.6 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -89.4 -34.37 16.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -105.08 -4.1 22.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.221 0.534 . . . . 0.0 110.909 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.64 63.69 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.315 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -59.97 -37.57 79.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.005 -0.598 . . . . 0.0 111.848 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.627 -0.702 . . . . 0.0 111.088 -176.349 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.52 109.32 6.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.652 0.263 . . . . 0.0 110.676 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.3 m -64.24 -16.39 61.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.17 0.509 . . . . 0.0 110.698 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.681 ' HA ' HG13 ' A' ' 7' ' ' ILE . 60.9 m-85 -66.42 -27.97 68.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.468 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -63.99 -37.17 86.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.391 0.615 . . . . 0.0 109.553 175.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -73.14 -44.17 60.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.207 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.848 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.75 -37.8 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.446 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LEU . . . . . 0.433 ' N ' HD12 ' A' ' 7' ' ' ILE . 34.9 tp -99.89 -87.81 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.504 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' LEU . 5.7 p-10 170.65 -11.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.212 0.605 . . . . 0.0 110.376 177.786 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 19' ' ' ILE . 19.8 m -119.95 151.67 52.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.502 174.973 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -90.31 -168.18 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.217 2.611 . . . . 0.0 113.639 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -78.53 -31.48 47.57 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 m -70.58 -7.29 42.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.995 0.426 . . . . 0.0 111.29 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.3 144.06 40.47 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.036 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.7 t -74.94 154.93 37.93 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.229 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.24 -41.12 62.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.92 0.391 . . . . 0.0 111.434 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.42 -34.41 77.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.578 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -68.85 -41.13 78.86 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.479 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.0 mp -60.66 -41.88 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.314 0.578 . . . . 0.0 109.692 172.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.413 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -59.15 -42.66 91.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.011 177.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -42.77 86.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.607 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.33 -41.47 93.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.567 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TYR . . . . . 0.67 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -64.22 -42.02 96.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.921 175.085 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -65.03 -43.53 92.09 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 25.3 ptt180 -69.86 -39.21 76.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -64.54 -39.82 94.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.24 -39.26 92.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.122 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -40.29 90.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.066 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 26.9 mm-40 -62.85 -37.32 86.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.261 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' TRP . . . . . 0.43 ' CE3' ' HB3' ' A' ' 45' ' ' LYS . 13.2 m0 -110.18 19.42 18.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.086 0.47 . . . . 0.0 111.269 -176.739 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.71 141.2 82.07 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.58 -29.11 68.47 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.382 2.722 . . . . 0.0 112.362 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.22 -33.31 75.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.77 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -115.83 18.9 15.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.734 -173.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.46 ' OD1' ' HD2' ' A' ' 39' ' ' LYS . 26.8 t-20 -115.51 135.16 22.57 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.851 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 58.8 Cg_endo -88.12 -106.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.924 2.416 . . . . 0.0 114.05 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -97.06 -8.41 30.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -171.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -103.25 99.41 9.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 12.4 mmmm -101.99 -30.0 11.46 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.227 -171.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -61.33 -45.53 94.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.002 -174.273 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -72.04 -36.4 69.62 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.168 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.58 -44.3 96.66 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.727 0.298 . . . . 0.0 111.007 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.55 -42.3 74.77 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.081 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -70.16 -37.71 75.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.324 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 64.4 mmtt -68.26 -35.18 77.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.657 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -62.84 -39.71 95.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.694 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -65.53 -44.01 88.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.388 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -66.34 -42.62 87.86 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.77 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.67 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.0 p -66.11 -37.29 79.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.876 178.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -62.19 -45.44 93.37 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 111.599 -178.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.56 -37.65 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.071 0.462 . . . . 0.0 110.41 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.848 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.4 -39.29 59.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.085 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.528 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -72.12 -35.34 69.11 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 179.01 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -61.63 -48.11 82.34 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.577 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.63 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 14.3 p -65.63 -38.8 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.955 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.441 HD22 ' HB3' ' A' ' 4' ' ' TYR . 52.5 tp -72.67 -28.19 62.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 t -78.57 -20.09 51.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.989 0.423 . . . . 0.0 110.328 -176.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.751 ' HB2' ' HB2' ' A' ' 61' ' ' LYS . 73.1 m-20 -111.77 121.85 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.595 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 3.4 mppt? -67.2 -34.29 77.19 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' HG12 ' A' ' 64' ' ' ILE . 81.9 m-70 -69.73 -32.86 71.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.076 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.751 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.2 tppp? -71.41 -41.68 69.28 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.63 ' HG3' ' O ' ' A' ' 55' ' ' VAL . 25.7 mtp180 -61.98 -42.6 99.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.576 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 13.1 pt-20 -67.55 -33.12 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.202 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.6 mm -65.2 -44.11 95.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 175.012 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -59.15 -37.48 77.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.259 0.552 . . . . 0.0 109.876 175.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -72.27 -47.25 51.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.144 -176.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -88.49 -37.51 15.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.504 ' HA ' ' HG2' ' A' ' 71' ' ' GLU . 32.3 t80 -95.44 -9.49 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.877 0.37 . . . . 0.0 110.543 -173.825 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.69 -48.01 84.69 Favored Glycine 0 CA--C 1.51 -0.271 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.635 175.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.41 -25.98 68.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.473 -0.864 . . . . 0.0 111.465 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 68' ' ' TYR . 18.4 mm-40 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.07 -176.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.3 mmm . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.358 0.123 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.421 ' HB3' ' CE2' ' A' ' 5' ' ' TYR . . . -65.32 -45.88 82.53 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.662 0.268 . . . . 0.0 111.327 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.7 t 68.59 -14.09 0.29 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 172.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' TYR . . . . . 0.575 ' CD1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -62.69 -38.08 88.97 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 122.002 -0.436 . . . . 0.0 111.32 -176.956 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 2' ' ' ALA . 3.6 p90 -61.3 -32.14 71.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.034 174.781 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -73.71 -45.09 54.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.916 0.388 . . . . 0.0 111.077 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ILE . . . . . 0.782 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -71.72 -30.99 40.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.813 -176.403 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.0 tp -99.66 -87.03 0.37 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.424 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.75 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 23.9 t70 177.85 -33.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.038 0.447 . . . . 0.0 110.853 -174.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.02 156.52 56.77 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.417 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -92.99 174.48 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.487 2.791 . . . . 0.0 112.844 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.801 ' HD3' ' H ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -57.34 -22.67 43.9 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 114.711 -1.132 . . . . 0.0 113.842 -168.974 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 t -58.64 -24.12 60.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.925 0.393 . . . . 0.0 111.113 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.888 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -78.82 143.78 35.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.144 0.497 . . . . 0.0 111.719 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.7 t -78.54 164.66 24.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.658 173.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.14 -34.44 44.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.168 0.509 . . . . 0.0 111.451 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.99 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.813 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ASP . . . . . 0.888 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 11.3 t70 -69.34 -36.61 77.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.808 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.12 -43.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.995 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -65.13 -37.86 88.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.043 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.627 ' HA ' ' HE ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -70.24 -35.28 73.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.357 175.413 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.75 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -59.82 -42.09 92.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.26 0.552 . . . . 0.0 110.736 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.66 -40.85 96.13 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.408 173.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.627 ' HE ' ' HA ' ' A' ' 21' ' ' LYS . 9.9 mtm180 -67.19 -45.57 76.51 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.897 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 29' ' ' GLN . 1.6 ptm180 -64.81 -32.63 74.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.865 0.364 . . . . 0.0 110.336 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 0.6 OUTLIER -71.31 -38.89 71.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.126 0.489 . . . . 0.0 110.139 176.979 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.19 -37.09 66.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.74 171.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 8.1 mp -67.86 -35.72 79.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.423 175.397 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' A' ' 26' ' ' LYS . 50.9 mt-30 -62.24 -34.23 76.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.056 0.455 . . . . 0.0 110.295 177.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -106.39 18.72 21.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.504 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.558 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.42 152.05 94.07 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.445 -178.439 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.704 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 11.2 Cg_endo -54.92 -29.36 63.54 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.231 2.62 . . . . 0.0 112.791 -178.157 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.734 ' HB2' ' HD2' ' A' ' 34' ' ' LYS . 1.3 m-20 -60.92 -34.78 75.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.338 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.734 ' HD2' ' HB2' ' A' ' 33' ' ' ASP . 0.1 OUTLIER -108.11 18.06 21.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.719 -178.256 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASN . . . . . 0.704 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.4 t-20 -116.18 136.27 22.98 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.097 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.433 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 53.1 Cg_endo -85.73 -121.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.947 2.432 . . . . 0.0 112.723 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . 0.433 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 43.7 m-20 -97.44 -9.17 27.77 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.894 0.378 . . . . 0.0 111.137 -177.098 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.34 101.95 11.46 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 51.4 mttm -99.42 -21.04 16.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -57.27 -42.89 82.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -67.35 -35.6 79.72 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.829 0.347 . . . . 0.0 110.309 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 24.3 mt-10 -69.44 -42.24 75.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 109.825 176.097 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 46.8 tptt -57.67 -46.7 83.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.705 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 65.1 mmtt -66.0 -35.49 80.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.29 -39.9 89.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.789 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 95.2 mttt -66.7 -44.21 82.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.222 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 16.5 mm-40 -65.11 -41.5 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 p -71.04 -37.3 66.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.603 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.15 92.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.607 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 9.6 pt-20 -71.36 -41.6 69.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.173 0.511 . . . . 0.0 110.372 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ALA . . . . . 0.782 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -68.65 -42.7 77.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.534 -174.642 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -38.31 71.35 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -69.89 -43.45 71.75 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.511 -175.339 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.605 HG22 ' HD2' ' A' ' 62' ' ' ARG . 11.8 p -68.27 -37.23 77.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.588 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 56' ' ' LEU . 1.9 tm? -72.17 -26.0 61.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.907 0.384 . . . . 0.0 110.327 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 t -76.32 -19.85 57.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.076 -174.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.624 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 23.1 t70 -112.36 121.63 45.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.42 0.629 . . . . 0.0 109.916 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.908 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.68 -37.22 85.88 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.99 -174.441 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 47.0 t60 -68.91 -39.54 79.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.287 -179.208 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . 0.624 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 41.5 mmtm -60.96 -36.15 78.64 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.219 177.029 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ARG . . . . . 0.605 ' HD2' HG22 ' A' ' 55' ' ' VAL . 9.8 mmm180 -63.81 -46.39 85.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.203 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.2 pt-20 -65.43 -38.85 91.12 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.718 -0.393 . . . . 0.0 109.983 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 ' HD3' ' A' ' 67' ' ' ARG . 44.5 mm -67.8 -44.09 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.551 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -60.93 -42.79 98.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.259 -176.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.29 -42.06 62.85 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' HD3' HD13 ' A' ' 64' ' ' ILE . 8.0 ptm180 -72.17 -30.9 65.44 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 111.452 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.431 ' HB3' ' O ' ' A' ' 64' ' ' ILE . 0.1 OUTLIER -103.96 -6.13 21.54 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.421 0.629 . . . . 0.0 110.943 -174.446 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.47 -48.99 67.79 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.472 -0.785 . . . . 0.0 113.619 -178.377 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -58.4 -46.23 86.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -176.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.394 -0.813 . . . . 0.0 110.513 -179.521 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 m . . . . . 0 N--CA 1.466 0.359 0 N-CA-C 112.308 0.484 . . . . 0.0 112.308 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.638 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 30.2 t80 -59.13 -35.34 73.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -177.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -56.82 -42.61 79.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.139 0.495 . . . . 0.0 110.21 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -74.63 -45.09 47.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.928 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.901 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.2 pp -72.8 -40.88 61.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -167.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.67 -106.08 0.25 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.322 -169.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.461 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 26.6 t70 -140.53 -35.71 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.84 -171.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.542 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 31.6 m -129.79 162.08 55.62 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.693 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.542 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.8 Cg_endo -62.11 160.78 28.84 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.589 2.859 . . . . 0.0 113.108 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.6 106.74 11.85 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.909 0.861 . . . . 0.0 109.182 175.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -176.65 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 145.59 47.35 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.086 173.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -68.08 165.74 17.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.19 -177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.577 ' HA ' HD13 ' A' ' 19' ' ' ILE . . . -51.88 -30.11 22.66 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.074 0.464 . . . . 0.0 111.843 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.5 -44.39 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -68.84 -34.99 76.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.212 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' CZ ' ' A' ' 4' ' ' TYR . 1.9 mp -57.54 -47.8 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.673 176.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -65.83 -38.29 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.056 0.455 . . . . 0.0 110.126 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 1.2 tmtt? -69.68 -35.42 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.733 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -63.85 -35.86 82.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 110.462 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.682 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -64.01 -48.04 77.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.188 173.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 71.9 mtp180 -64.68 -43.25 94.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.357 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 8.9 ptp85 -65.21 -39.96 93.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.719 0.295 . . . . 0.0 110.439 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HA ' ' HB3' ' A' ' 29' ' ' GLN . 24.1 ttmm -71.73 -35.81 70.27 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.573 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.87 -44.96 74.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.189 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 10.7 mp -71.48 -34.81 70.51 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.782 175.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 33.5 tt0 -61.66 -36.82 81.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.393 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.558 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 95.3 m95 -111.85 19.35 18.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.342 0.592 . . . . 0.0 110.82 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.612 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 27.7 t60 -72.14 145.04 88.07 Favored Pre-proline 0 C--N 1.322 -0.61 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.612 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.4 Cg_endo -54.21 -28.73 53.36 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.866 3.044 . . . . 0.0 113.633 -174.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.38 -25.17 65.83 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.123 0.487 . . . . 0.0 110.134 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.72 2.59 21.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.117 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.602 HD21 ' HG3' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -104.04 140.29 20.93 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 120.939 0.399 . . . . 0.0 110.216 -176.108 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 62.6 Cg_endo -87.34 -119.52 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.047 2.498 . . . . 0.0 112.757 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.409 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 4.0 m-20 -86.91 -8.05 57.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.114 0.483 . . . . 0.0 111.157 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.569 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 55.1 m-80 -102.47 102.95 13.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.242 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.602 ' HG3' HD21 ' A' ' 35' ' ' ASN . 0.1 OUTLIER -97.77 -31.07 12.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.949 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -61.75 -44.88 96.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.205 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 82.6 m-85 -66.79 -37.43 84.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.448 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -68.15 -45.99 72.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.029 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.3 pt-20 -70.3 -36.22 74.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.546 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 8.5 ttmm -59.53 -44.44 93.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 120.864 0.364 . . . . 0.0 110.147 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' HG12 ' A' ' 49' ' ' VAL . 62.9 mmtt -68.12 -39.64 82.72 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -62.44 -41.59 98.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.377 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 51.3 mtmt -68.34 -44.11 76.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.749 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 12.7 pt-20 -72.27 -36.28 68.97 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.682 HG21 ' HA ' ' A' ' 23' ' ' TYR . 7.8 p -67.21 -38.38 80.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.085 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.84 -44.46 96.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 11.5 pt-20 -72.7 -40.66 66.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.967 0.413 . . . . 0.0 111.083 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.901 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.04 -40.03 68.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.454 -175.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -69.28 -34.23 74.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 175.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.46 -50.26 74.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.901 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.606 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 3.2 m -67.93 -40.98 84.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.5 HD23 HG12 ' A' ' 19' ' ' ILE . 31.1 tp -73.1 -28.83 62.5 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.169 -0.612 . . . . 0.0 112.06 -175.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.9 t -77.98 -22.63 49.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.784 0.326 . . . . 0.0 110.228 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.826 ' HB3' ' HG3' ' A' ' 61' ' ' LYS . 11.7 t70 -112.41 121.67 45.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.082 0.468 . . . . 0.0 109.747 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.594 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 3.0 mptp? -66.56 -34.99 79.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.005 -170.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.514 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.5 t-80 -69.68 -42.16 74.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.517 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.826 ' HG3' ' HB3' ' A' ' 58' ' ' ASP . 4.6 mtpt -60.49 -33.76 73.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.623 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 14.9 mtm105 -60.63 -46.67 89.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.03 0.443 . . . . 0.0 110.654 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 14.8 pt-20 -71.84 -30.12 65.13 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.592 -176.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.823 HD13 ' HD3' ' A' ' 67' ' ' ARG . 47.8 mm -63.65 -38.02 81.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -65.24 -39.92 93.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.277 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -72.83 -45.73 56.8 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.823 ' HD3' HD13 ' A' ' 64' ' ' ILE . 9.0 ptm180 -71.61 -41.71 68.56 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 122.33 -0.231 . . . . 0.0 111.388 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.01 -0.46 57.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.512 0.673 . . . . 0.0 109.773 -174.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.59 -48.76 8.66 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 166.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -65.75 -45.51 82.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.431 -0.885 . . . . 0.0 111.585 175.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.953 179.146 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.1 m . . . . . 0 N--CA 1.47 0.536 0 N-CA-C 112.225 0.454 . . . . 0.0 112.225 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.503 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -61.32 -36.85 81.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.862 -178.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.551 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 2.1 p90 -57.35 -39.3 75.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.153 175.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.551 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 8.0 mm-40 -73.88 -44.36 55.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.463 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.52 HD11 HD11 ' A' ' 56' ' ' LEU . 2.3 pp -71.15 -31.73 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.715 -173.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.7 tp -97.39 -78.37 0.48 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.801 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 177.56 -44.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.251 0.548 . . . . 0.0 110.222 -175.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 27.5 m -120.5 156.14 55.92 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.642 -170.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.475 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 87.1 Cg_endo -81.74 174.66 10.13 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.201 2.6 . . . . 0.0 112.042 176.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.411 ' HG2' ' H ' ' A' ' 12' ' ' ARG . 7.3 ptm85 -78.05 -8.92 58.82 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.392 -174.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 m -69.35 -13.85 62.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.082 0.467 . . . . 0.0 110.776 176.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.98 144.27 28.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.6 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 m -72.74 163.59 27.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.738 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.28 -40.14 61.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -173.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.15 -34.52 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.358 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 21.1 t70 -69.66 -40.03 76.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.81 -40.93 88.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.825 172.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.887 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 26.7 ttpp -57.59 -43.33 84.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.556 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.781 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.2 mmpt? -63.54 -35.98 82.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.537 174.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.55 -47.88 77.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.887 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 12.4 p90 -70.09 -36.93 75.26 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.894 -0.722 . . . . 0.0 109.849 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.8 mmt180 -57.52 -45.7 84.69 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.893 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 6.3 ptp180 -67.07 -39.18 86.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.797 0.332 . . . . 0.0 110.514 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -64.76 -38.27 90.42 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.92 -36.27 80.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.074 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 6.4 mp -69.68 -36.21 75.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.404 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.23 -37.4 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.769 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -108.22 20.27 18.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.808 0.337 . . . . 0.0 111.064 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.2 t-80 -72.02 140.67 83.38 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.526 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 9.3 Cg_endo -53.07 -37.28 79.02 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.731 2.287 . . . . 0.0 113.327 -167.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -67.88 -26.49 66.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 111.162 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 12.9 mmtp -107.34 15.12 25.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.498 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -107.76 134.33 20.1 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.365 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 95.7 Cg_endo -81.26 -120.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 122.951 2.434 . . . . 0.0 113.251 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.42 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 20.9 m-20 -97.04 -9.33 28.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 111.613 -173.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.451 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.9 m120 -100.69 101.62 12.54 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.578 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.5 OUTLIER -93.53 -29.63 15.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.314 -174.581 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -54.43 -44.84 72.77 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.549 0.531 . . . . 0.0 110.979 -174.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 89.9 m-85 -62.61 -43.11 99.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.03 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.84 96.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.016 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 15.7 mt-10 -69.56 -44.14 71.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.024 0.44 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -64.98 -41.48 95.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.287 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 66.5 mmtt -71.69 -34.57 69.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.661 0.267 . . . . 0.0 110.333 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -60.76 -39.27 88.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.085 0.469 . . . . 0.0 109.751 174.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.94 -45.77 84.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.488 174.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -63.74 -43.93 95.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.467 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 23' ' ' TYR . 11.2 p -67.35 -36.72 77.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.782 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.695 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . . . -63.87 -45.77 87.93 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.91 0.386 . . . . 0.0 111.74 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -70.69 -36.8 73.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.544 0.688 . . . . 0.0 109.979 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -73.97 -45.94 47.06 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.662 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.695 ' CD2' ' HA ' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.13 -34.77 78.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -51.24 68.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.322 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' A' ' 52' ' ' ALA . 14.6 p -71.84 -39.09 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 52' ' ' ALA . 46.6 mt -68.47 -24.29 64.68 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -172.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.8 t -78.3 -23.11 47.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.907 0.385 . . . . 0.0 110.36 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -114.33 121.58 44.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.0 111.027 -177.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.28 -36.25 83.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.691 -178.064 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.443 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 32.2 m-70 -69.14 -41.86 76.76 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.853 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 61' ' ' LYS . 26.7 ttmt -63.09 -33.78 76.18 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.07 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -62.13 -37.14 84.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.821 174.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 41.5 mt-10 -63.38 -43.08 98.62 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.114 0.483 . . . . 0.0 110.175 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.14 -44.93 95.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -66.19 -35.36 80.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.19 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.8 -47.38 69.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -82.67 -41.28 19.58 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -93.19 9.91 34.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.561 0.696 . . . . 0.0 110.112 -171.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -87.03 -47.59 4.68 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 169.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -66.7 -42.36 86.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.366 -0.917 . . . . 0.0 110.659 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 C--O 1.246 0.921 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m . . . . . 0 N--CA 1.463 0.176 0 CA-C-O 120.98 0.419 . . . . 0.0 111.665 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.2 m-85 -68.5 -33.71 74.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.112 0.482 . . . . 0.0 110.458 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.79 -35.07 78.65 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.518 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -74.55 -43.97 53.23 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.138 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.669 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -69.51 -40.96 80.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -174.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 7' ' ' ILE . 32.6 tp -102.58 -104.02 0.28 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.011 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.553 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 7.2 m-20 -158.48 -22.65 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.125 -177.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.4 m -118.48 158.52 46.74 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.647 -176.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.618 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.3 Cg_endo -59.3 -81.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.079 2.519 . . . . 0.0 114.118 -172.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' HD11 ' A' ' 56' ' ' LEU . 37.8 ptt180 -171.32 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -177.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.5 t -97.25 27.41 4.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.304 0.573 . . . . 0.0 110.455 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.44 145.92 30.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.497 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.5 m -55.37 128.58 34.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . 0.599 ' O ' ' HG2' ' A' ' 20' ' ' LYS . . . -53.23 -33.75 54.22 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -170.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.75 -34.8 77.95 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.878 0.371 . . . . 0.0 110.753 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.82 -35.81 77.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.754 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.802 HG21 ' HB2' ' A' ' 57' ' ' SER . 2.4 mp -59.72 -42.68 89.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.733 170.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 16' ' ' ALA . 71.0 mmtt -61.22 -37.91 84.72 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.562 175.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.604 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.63 -47.44 78.54 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.26 176.749 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 9' ' ' ASP . . . -60.63 -39.57 88.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.136 0.494 . . . . 0.0 110.466 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.528 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -67.57 -50.0 60.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.486 176.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtt85 -68.36 -37.78 80.79 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 25' ' ' ARG . 8.4 ttt-85 -62.12 -44.44 96.64 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.973 0.416 . . . . 0.0 110.742 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.635 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.2 ttmm -66.46 -42.34 87.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 110.078 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.99 84.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.293 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -66.86 -37.05 83.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.538 -177.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -64.12 -34.82 78.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 0.0 110.925 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 99.1 m95 -106.45 19.3 20.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.288 0.566 . . . . 0.0 110.546 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.512 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.27 152.2 94.38 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.356 -178.427 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.1 Cg_endo -54.81 -30.09 66.01 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.492 2.128 . . . . 0.0 112.074 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.8 -24.38 62.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.899 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.43 -3.42 12.42 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -173.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 29.9 p30 -103.54 140.25 20.88 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.262 0.554 . . . . 0.0 110.458 -176.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 55.5 Cg_endo -92.19 -104.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.155 2.57 . . . . 0.0 112.85 -177.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -98.12 -7.21 30.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.84 0.352 . . . . 0.0 111.854 -176.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -94.34 100.91 12.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 0.0 110.182 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -101.63 -29.54 11.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.52 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.85 -43.6 90.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.227 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -71.02 -37.48 72.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.627 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 30' ' ' TRP . . . -63.5 -43.87 95.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.949 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.577 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 10.2 pt-20 -69.55 -38.94 77.68 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.323 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -59.76 -47.8 84.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.684 0.278 . . . . 0.0 110.949 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 67.1 mmtt -65.09 -35.22 80.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.687 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -67.08 -40.73 87.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.475 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 88.2 mttt -68.36 -46.52 69.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 11.9 pt-20 -67.29 -37.49 83.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.376 -175.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.635 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 14.7 p -71.8 -37.72 63.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.334 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -44.37 94.59 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.336 -178.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.96 -40.92 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.19 0.519 . . . . 0.0 110.603 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.669 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.2 -38.93 60.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.083 -175.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.518 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.5 -35.75 68.23 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.45 -45.55 90.35 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.399 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.745 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 11.1 p -70.23 -41.07 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.738 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.474 HD11 ' HA ' ' A' ' 12' ' ' ARG . 58.4 tp -74.31 -30.93 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . 0.802 ' HB2' HG21 ' A' ' 19' ' ' ILE . 32.1 t -81.72 -21.17 38.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.731 0.301 . . . . 0.0 110.98 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 20.2 t70 -111.83 124.46 52.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 -174.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -66.93 -32.19 73.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.505 ' O ' HG12 ' A' ' 64' ' ' ILE . 43.0 m-70 -68.39 -41.89 79.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 177.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.745 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 5.9 mptp? -61.51 -36.71 81.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.568 174.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 46.8 mmm-85 -59.94 -40.8 90.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.059 0.457 . . . . 0.0 109.842 174.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 44.1 mt-10 -65.22 -40.17 93.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.996 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 60' ' ' HIS . 42.4 mm -64.43 -44.45 97.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.776 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.05 -37.33 87.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.914 0.388 . . . . 0.0 110.501 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.08 -45.09 95.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -88.73 -48.05 7.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -94.64 -9.74 34.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.861 0.362 . . . . 0.0 111.248 -170.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.16 -44.63 97.46 Favored Glycine 0 CA--C 1.506 -0.479 0 N-CA-C 111.198 -0.761 . . . . 0.0 111.198 175.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -66.7 -34.28 77.5 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.25 -0.975 . . . . 0.0 111.559 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.957 -177.569 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m . . . . . 0 CA--C 1.531 0.243 0 CA-C-O 121.411 0.625 . . . . 0.0 110.793 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.579 ' HA ' HG13 ' A' ' 7' ' ' ILE . 98.7 m-85 -68.79 -23.86 64.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.559 176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -56.59 -33.01 65.8 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.0 -44.37 61.11 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.411 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.851 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.8 -39.18 67.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.826 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.491 ' N ' HD12 ' A' ' 7' ' ' ILE . 38.4 tp -100.59 -90.56 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 171.1 -16.04 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.513 0.725 . . . . 0.0 109.924 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.98 152.46 56.48 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.975 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -87.59 165.49 7.76 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.907 2.405 . . . . 0.0 112.524 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.808 ' HB3' HD11 ' A' ' 56' ' ' LEU . 11.0 ptm180 -70.15 -3.91 18.98 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.472 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 t -56.02 -33.5 64.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.261 172.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -76.34 146.03 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.423 177.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.8 p -63.76 155.81 29.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.231 177.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.84 64.11 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -170.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.481 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 21.7 m-20 -62.7 -34.42 77.1 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.979 0.418 . . . . 0.0 111.346 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.401 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 5.2 t70 -62.41 -41.37 98.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.865 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.447 HG23 HD22 ' A' ' 8' ' ' LEU . 1.9 mp -62.61 -39.19 83.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.6 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 90.9 mttt -58.24 -41.29 83.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.251 177.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -68.88 -36.01 77.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.509 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.34 -35.96 82.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.23 0.538 . . . . 0.0 110.075 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.698 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -65.67 -43.6 88.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.835 174.56 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -68.22 -38.51 81.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.764 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.418 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 4.0 ptm180 -69.37 -36.7 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.902 0.382 . . . . 0.0 110.488 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 21.2 ttmm -70.92 -42.48 69.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 121.163 0.506 . . . . 0.0 109.769 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.38 -45.82 84.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.946 176.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.71 -37.32 83.72 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.936 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -65.63 -31.19 72.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.337 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.555 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 98.6 m95 -105.4 13.37 30.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.069 0.461 . . . . 0.0 111.462 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -82.04 147.75 58.58 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.56 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 12.2 Cg_endo -54.25 -29.4 56.97 Favored 'Trans proline' 0 N--CA 1.477 0.501 0 C-N-CA 124.27 3.313 . . . . 0.0 113.625 -167.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -64.2 -30.59 71.64 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.105 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -111.56 7.55 20.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.56 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 27.0 t-20 -107.98 140.06 21.28 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.467 -176.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 91.4 Cg_endo -78.02 -117.76 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.863 2.375 . . . . 0.0 112.753 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.413 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 2.5 m-20 -97.11 -7.03 33.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.591 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 16.8 m120 -103.59 99.02 8.82 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.206 -173.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -93.06 -25.77 17.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.867 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 7.8 tm-20 -60.85 -44.08 97.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.666 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.591 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 54.7 m-85 -71.97 -37.83 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 175.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.87 -46.21 88.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.641 0.258 . . . . 0.0 111.184 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -69.32 -35.63 76.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 5.1 tttp -58.77 -48.43 81.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.629 177.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.434 ' O ' HG12 ' A' ' 49' ' ' VAL . 63.7 mmtt -72.01 -34.99 69.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.911 -178.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.98 -40.19 92.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.243 0.544 . . . . 0.0 109.689 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -67.37 -45.87 75.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.467 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.79 -43.3 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.635 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.698 HG22 ' HD1' ' A' ' 23' ' ' TYR . 12.0 p -67.89 -37.4 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.909 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.73 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.775 0.322 . . . . 0.0 111.263 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.08 -36.85 69.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.078 0.466 . . . . 0.0 110.525 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.851 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.62 -38.53 58.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.091 -173.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -36.08 72.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -65.03 -47.08 78.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.612 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.616 ' HA ' ' CB ' ' A' ' 61' ' ' LYS . 11.8 p -64.68 -38.71 83.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.37 . . . . 0.0 111.145 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 12' ' ' ARG . 48.1 tp -74.08 -29.15 61.72 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.7 t -84.19 -19.55 33.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.495 0.188 . . . . 0.0 111.205 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 23.3 t70 -112.36 129.99 56.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.383 0.611 . . . . 0.0 111.56 -174.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.723 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.69 -36.06 81.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.153 -175.425 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.416 ' O ' HD13 ' A' ' 64' ' ' ILE . 35.5 m170 -69.75 -41.89 74.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.128 0.49 . . . . 0.0 110.227 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.809 ' HA ' ' HE2' ' A' ' 61' ' ' LYS . 10.5 mmpt? -61.15 -37.76 84.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.603 176.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 89.0 mtt180 -61.77 -47.22 86.17 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.758 0.313 . . . . 0.0 111.427 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -71.39 -35.8 71.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.611 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.6 mp -65.11 -39.19 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.62 -38.02 83.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.401 . . . . 0.0 110.629 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -73.08 -47.72 42.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.453 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 64' ' ' ILE . 8.6 ptm180 -77.01 -30.93 56.06 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -173.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -94.85 -10.14 32.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.286 0.565 . . . . 0.0 110.053 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.64 -47.27 10.25 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.312 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -62.82 -27.64 69.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.003 -0.598 . . . . 0.0 111.832 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.464 -0.779 . . . . 0.0 111.376 -176.526 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.9 p . . . . . 0 N--CA 1.453 -0.285 0 CA-C-O 121.261 0.553 . . . . 0.0 110.191 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.518 ' O ' HG13 ' A' ' 7' ' ' ILE . 57.2 m-85 -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.794 176.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.38 -32.7 73.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.427 176.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -73.36 -44.03 59.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.07 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.5 pp -70.22 -40.54 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.38 -176.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 20.2 tp -102.29 -93.08 0.31 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.412 ' H ' ' H ' ' A' ' 10' ' ' VAL . 4.5 p30 174.27 3.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.021 0.826 . . . . 0.0 110.771 173.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.453 HG22 HD23 ' A' ' 8' ' ' LEU . 17.0 m -121.11 154.39 58.26 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-O 120.643 0.258 . . . . 0.0 110.985 176.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.41 161.7 43.74 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.181 2.587 . . . . 0.0 112.619 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.534 ' HD3' ' N ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -68.6 -20.4 64.5 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.501 -175.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . 0.534 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 21.0 m -77.32 -2.51 35.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.328 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.725 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -74.22 143.49 45.11 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.338 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -86.04 173.01 10.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.993 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.23 -39.7 60.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -64.84 -41.16 95.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.338 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.725 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 3.3 m-20 -62.01 -44.12 97.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.248 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.639 HG22 ' HD2' ' A' ' 53' ' ' TYR . 1.9 mp -63.92 -38.67 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.456 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -36.08 80.82 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.798 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.1 mmpt? -64.07 -46.62 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.122 175.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.405 ' HB2' HG13 ' A' ' 10' ' ' VAL . . . -63.74 -37.51 87.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 110.591 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.621 ' HA ' HG21 ' A' ' 49' ' ' VAL . 2.7 t80 -63.02 -46.7 86.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.792 175.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -67.55 -37.2 82.33 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -176.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 25' ' ' ARG . 5.4 ptp180 -67.89 -40.76 83.48 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.177 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.937 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.6 ttmm -70.23 -42.5 72.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.371 0.605 . . . . 0.0 109.56 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.55 -44.7 85.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.399 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.5 -46.25 90.79 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.391 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -63.09 -31.54 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.139 -177.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.716 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 89.1 m95 -106.09 18.89 21.37 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.077 0.465 . . . . 0.0 111.323 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m170 -83.65 143.75 44.46 Favored Pre-proline 0 C--N 1.32 -0.675 0 O-C-N 122.069 -0.395 . . . . 0.0 110.165 173.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.0 -25.92 56.29 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.671 2.914 . . . . 0.0 111.941 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -59.73 -33.63 71.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.21 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -113.68 -29.88 6.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.675 HD22 ' HB2' ' A' ' 42' ' ' ALA . 65.7 t30 -102.44 132.5 21.32 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.62 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 74.2 Cg_endo -73.61 -115.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.982 2.454 . . . . 0.0 115.699 -167.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.44 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 6.7 m-20 -85.91 -7.2 58.85 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -165.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -101.62 98.41 8.71 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.38 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -103.92 -23.13 13.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.767 -176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 21.5 tt0 -66.26 -41.02 90.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.299 0.571 . . . . 0.0 110.601 -178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.34 -37.46 83.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.83 177.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.716 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.66 -44.39 81.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.029 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 12.9 pt-20 -67.34 -36.46 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.75 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -60.05 -40.85 90.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.715 0.293 . . . . 0.0 110.706 174.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 68.2 mmtt -71.84 -35.25 69.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.799 0.333 . . . . 0.0 110.565 177.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.44 -39.33 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.718 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -65.31 -41.72 93.77 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.431 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.28 -43.2 98.6 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.473 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.937 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 6.7 p -70.42 -38.84 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.524 178.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HA ' ' HD1' ' A' ' 53' ' ' TYR . . . -61.43 -45.07 95.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.554 0.216 . . . . 0.0 111.58 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.0 pt-20 -71.91 -43.63 65.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.017 0.437 . . . . 0.0 111.032 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.63 67.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.43 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.639 ' HD2' HG22 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -70.63 -33.66 71.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -60.68 -42.31 96.84 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.535 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.775 HG13 ' HG3' ' A' ' 61' ' ' LYS . 64.3 t -69.04 -44.81 80.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.001 0.429 . . . . 0.0 110.566 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.561 ' HG ' HG12 ' A' ' 19' ' ' ILE . 40.3 tp -72.25 -17.48 61.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.323 -175.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.8 m -82.83 -18.39 40.61 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 122.043 -0.41 . . . . 0.0 111.922 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -109.01 123.4 49.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.202 0.525 . . . . 0.0 111.482 -175.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -61.08 -38.01 84.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.653 -177.734 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.421 ' O ' HD13 ' A' ' 64' ' ' ILE . 80.6 t60 -65.12 -40.51 94.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.775 ' HG3' HG13 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -70.28 -33.63 71.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.382 177.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.74 -47.46 83.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.097 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -71.32 -34.96 71.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.863 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.421 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.5 mp -65.04 -42.5 94.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -65.62 -36.73 84.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.978 0.418 . . . . 0.0 110.225 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.19 -47.84 78.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.661 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.686 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 10.8 ptm180 -88.58 -48.86 7.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -94.3 -10.56 32.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.92 0.391 . . . . 0.0 111.176 -168.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.4 -49.32 6.29 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.474 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -67.42 -25.52 65.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.673 -0.763 . . . . 0.0 112.751 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.686 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 75.4 mm-40 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.929 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.807 ' HA ' HG12 ' A' ' 7' ' ' ILE . 66.8 m-85 -68.44 -26.12 65.36 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.67 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.0 -39.31 81.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.667 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -73.51 -44.21 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.847 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.831 HD12 ' HB1' ' A' ' 52' ' ' ALA . 12.4 pt -71.81 -42.31 69.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -172.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.511 ' N ' HG13 ' A' ' 7' ' ' ILE . 15.6 mt -103.85 -75.3 0.62 Allowed 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 120.966 0.412 . . . . 0.0 109.937 176.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 168.95 -30.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.514 -174.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.0 m -120.66 154.12 56.98 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.9 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.76 -178.63 4.54 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.994 2.463 . . . . 0.0 112.616 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.85 -17.58 61.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.99 0.424 . . . . 0.0 111.346 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -23.42 66.7 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.562 175.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 145.84 44.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.914 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.2 m -67.63 159.78 29.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.978 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.04 -36.27 60.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.179 0.514 . . . . 0.0 111.223 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -61.5 -40.28 94.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.812 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -62.2 -44.61 96.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.657 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.85 -45.73 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.748 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.5 ttmm -60.83 -40.85 94.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.773 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HD2' ' HA ' ' A' ' 21' ' ' LYS . 9.6 mmmm -70.33 -35.56 73.69 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.92 -41.58 96.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.268 0.556 . . . . 0.0 109.642 173.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.54 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -65.47 -44.11 88.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.012 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -61.88 -41.16 97.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.748 0.309 . . . . 0.0 111.629 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -67.48 -44.12 79.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.503 . . . . 0.0 110.952 175.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CG ' ' HB ' ' A' ' 49' ' ' VAL . 3.6 tppp? -60.35 -38.59 84.29 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.311 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.707 ' HA ' ' NE1' ' A' ' 30' ' ' TRP . . . -60.62 -42.13 96.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.995 175.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.4 -35.4 73.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.65 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 24.2 mm-40 -60.38 -33.37 72.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.275 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.707 ' NE1' ' HA ' ' A' ' 27' ' ' ALA . 64.1 p-90 -106.46 6.42 30.24 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.626 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.1 m170 -74.2 146.99 85.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.563 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 17.0 Cg_endo -55.67 -28.1 64.3 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.758 2.972 . . . . 0.0 112.687 -176.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.82 -24.38 63.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.124 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -119.16 -10.87 9.69 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.563 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -104.44 133.86 19.98 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 92.1 Cg_endo -96.56 -112.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.394 2.73 . . . . 0.0 113.096 -177.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -85.23 -6.75 59.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.61 0.719 . . . . 0.0 110.065 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.769 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.2 m120 -90.66 103.09 15.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.731 -174.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -98.2 -29.32 13.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.091 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 34.1 tt0 -59.71 -44.69 93.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.133 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.769 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 93.4 m-85 -65.04 -37.65 88.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.913 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.25 -44.7 94.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.188 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.04 -37.95 75.72 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.748 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 55.7 mtpt -63.75 -46.29 85.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.616 0.246 . . . . 0.0 110.99 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.617 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 30.1 mmtp -66.55 -34.68 78.44 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.32 -50.89 71.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.077 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HB2' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -69.08 -43.15 75.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.103 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 9.1 pt-20 -64.83 -37.31 87.19 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.971 -175.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.54 HG22 ' HD1' ' A' ' 23' ' ' TYR . 13.1 p -72.42 -38.94 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 C-N-CA 120.139 -0.625 . . . . 0.0 110.869 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.33 -45.41 91.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 11.1 pt-20 -72.02 -43.16 65.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.058 -179.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.831 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -75.07 -42.48 56.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.177 -173.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 4.1 t80 -70.89 -35.57 72.39 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.215 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.96 -50.46 68.54 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.01 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.543 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.6 p -62.55 -41.3 91.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -175.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 tp -75.18 -28.96 60.24 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.1 m -85.9 -19.44 30.53 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.777 0.322 . . . . 0.0 111.043 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -102.51 124.22 47.68 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.593 0.711 . . . . 0.0 110.767 -177.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.677 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 8.0 mptt -68.86 -31.43 70.37 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.154 -175.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.61 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 87.9 m-70 -70.44 -43.83 69.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.187 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -65.08 -34.42 78.38 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 175.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 mmm180 -59.25 -41.66 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.625 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.61 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 41.7 mt-10 -60.59 -43.37 97.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.827 0.346 . . . . 0.0 110.799 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.36 -44.93 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -66.18 -35.25 79.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.234 0.54 . . . . 0.0 110.413 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.89 -45.79 87.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.611 -177.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -88.46 -37.56 15.71 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -101.0 9.87 41.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 0.0 111.495 -171.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.77 -56.43 4.15 Favored Glycine 0 CA--C 1.508 -0.369 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.53 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -66.62 -36.63 83.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.154 -0.523 . . . . 0.0 112.064 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.793 -0.623 . . . . 0.0 111.012 -176.734 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.3 p . . . . . 0 N--CA 1.473 0.714 0 N-CA-C 113.822 1.045 . . . . 0.0 113.822 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.498 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 38.2 m-85 -68.82 -27.05 65.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.176 0.513 . . . . 0.0 110.971 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.563 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 1.3 p90 -66.78 -32.7 74.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.489 173.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.404 ' HG3' ' CD1' ' A' ' 5' ' ' TYR . 37.4 mt-10 -74.25 -43.83 55.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.124 177.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.498 ' CG1' ' HA ' ' A' ' 4' ' ' TYR . 2.5 pp -71.6 -33.21 48.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.781 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG23 ' A' ' 19' ' ' ILE . 54.0 tp -99.36 -79.69 0.48 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.966 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 176.35 -41.02 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.16 -175.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 m -122.99 151.55 61.52 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.197 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.563 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 27.4 Cg_endo -64.37 151.39 85.69 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.137 2.558 . . . . 0.0 112.166 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -73.38 -15.03 61.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.21 -172.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.9 m -62.2 -18.88 62.32 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.937 174.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -73.49 145.94 45.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.8 t -66.12 161.7 21.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.458 -177.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.5 50.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.202 0.525 . . . . 0.0 110.665 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -60.72 -41.89 96.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.411 178.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 10.5 m-20 -68.28 -41.24 81.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.497 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.616 HG22 ' HD1' ' A' ' 53' ' ' TYR . 1.7 mp -60.77 -42.85 93.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.932 174.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -62.0 -40.86 97.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.409 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.5 mmpt? -63.08 -40.97 99.24 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.4 176.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -60.45 -46.13 91.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.096 0.474 . . . . 0.0 110.258 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.476 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -61.94 -48.59 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.8 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.95 78.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.461 HH11 ' HD3' ' A' ' 25' ' ' ARG . 18.6 ttt-85 -60.58 -44.06 96.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.997 177.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.65 ' HD2' HG21 ' A' ' 49' ' ' VAL . 58.4 mttm -67.72 -37.19 81.9 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.267 0.556 . . . . 0.0 109.922 177.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.48 75.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.708 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 3.5 mm? -71.89 -35.78 69.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.01 0.433 . . . . 0.0 111.047 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.01 -38.78 89.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.847 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -109.61 20.69 17.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.348 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.48 ' HB2' ' HA ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -69.29 145.69 96.07 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.382 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 10.5 Cg_endo -53.52 -34.34 72.0 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 122.355 2.037 . . . . 0.0 113.098 -168.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.91 -24.17 63.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.072 0.463 . . . . 0.0 110.969 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -113.87 7.89 17.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.99 145.77 31.19 Favored Pre-proline 0 C--O 1.234 0.286 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.058 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 84.0 Cg_endo -81.44 -120.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.941 2.428 . . . . 0.0 112.949 -174.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.439 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 5.2 m-20 -97.11 -8.15 30.91 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.866 0.365 . . . . 0.0 111.218 -176.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -98.61 100.63 11.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.951 0.405 . . . . 0.0 110.26 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 13.8 mptt -92.61 -30.67 15.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.314 175.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 15.5 tp10 -60.84 -43.94 97.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.897 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -72.32 -38.29 68.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.586 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.32 90.83 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 11.2 pt-20 -71.22 -37.76 72.04 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.907 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 20.6 tptp -61.12 -45.96 92.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.549 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.405 ' O ' HG12 ' A' ' 49' ' ' VAL . 31.9 mmtp -65.96 -38.14 87.82 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.995 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -62.15 -40.08 94.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.653 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.4 mmtt -66.74 -41.77 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.856 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.32 -44.12 92.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.001 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 ' HD2' ' A' ' 26' ' ' LYS . 7.3 p -72.03 -38.28 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.007 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.08 95.6 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.213 -0.195 . . . . 0.0 111.37 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 10.7 pt-20 -72.05 -40.27 68.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.0 110.728 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 51' ' ' GLU . . . -72.39 -38.96 68.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.633 -174.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.84 -40.48 72.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -62.12 -49.88 74.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.012 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.02 -38.08 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 111.306 -177.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.0 tp -72.99 -26.26 61.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.772 0.32 . . . . 0.0 111.418 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -82.06 -18.8 41.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.674 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.483 ' HB3' ' HB2' ' A' ' 61' ' ' LYS . 17.6 t70 -110.35 122.2 47.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 0.0 110.318 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -66.35 -34.33 77.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.427 -174.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 33.6 t60 -71.97 -40.51 68.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.13 -34.32 77.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.972 177.339 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 66' ' ' ASP . 0.8 OUTLIER -60.15 -42.56 95.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.788 173.805 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.507 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 38.4 mt-10 -61.05 -44.71 96.98 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.176 0.512 . . . . 0.0 110.107 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 48.7 mm -68.82 -46.09 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.804 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -64.5 -35.91 82.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -177.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -70.32 -45.66 65.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.088 -174.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.582 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 9.1 ptm180 -85.61 -27.48 25.43 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.4 9.93 29.66 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.806 0.812 . . . . 0.0 109.792 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.82 -50.4 3.11 Favored Glycine 0 N--CA 1.442 -0.904 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.17 172.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -65.16 -46.92 78.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.755 -0.723 . . . . 0.0 111.812 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 9.5 pt-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.413 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.9 t . . . . . 0 CA--C 1.535 0.394 0 N-CA-C 111.941 0.348 . . . . 0.0 111.941 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.581 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 85.1 m-85 -62.54 -29.86 70.87 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.86 0.362 . . . . 0.0 111.52 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -34.78 78.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.914 0.388 . . . . 0.0 110.758 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -75.45 -43.87 47.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.899 176.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.613 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -67.82 -38.37 80.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.882 0.372 . . . . 0.0 111.039 -177.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.1 tp -101.01 -93.97 0.28 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 175.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.494 ' OD1' HG13 ' A' ' 10' ' ' VAL . 4.5 p30 -178.72 -19.87 0.0 OUTLIER 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.58 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.494 HG13 ' OD1' ' A' ' 9' ' ' ASP . 16.2 m -118.74 150.9 49.24 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.984 0.421 . . . . 0.0 110.768 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -94.85 -178.12 0.53 Allowed 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 123.405 2.737 . . . . 0.0 112.982 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.3 ptt85 -64.66 -27.56 69.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.682 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.8 p -63.3 -20.49 65.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.448 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.33 146.98 31.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.54 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.6 t -50.56 141.68 12.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.137 175.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.64 -31.92 64.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.004 0.43 . . . . 0.0 110.699 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.489 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 7.3 m-20 -65.91 -34.61 78.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.766 174.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.42 -43.26 77.57 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.222 178.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.537 HG12 ' CD1' ' A' ' 56' ' ' LEU . 2.0 mp -60.26 -38.95 79.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.35 0.595 . . . . 0.0 109.862 173.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -65.32 -34.72 79.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.912 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.81 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.37 -43.23 95.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 173.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.79 93.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.105 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -62.09 -42.65 99.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.135 176.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -66.83 -43.6 83.31 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.523 -177.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -70.15 -32.2 70.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.127 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -61.17 -43.47 98.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.423 0.63 . . . . 0.0 109.973 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.79 71.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.96 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.405 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.7 mp -68.37 -36.53 79.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.868 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -62.17 -39.57 93.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.885 0.374 . . . . 0.0 111.153 -178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -108.42 18.77 20.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.326 0.584 . . . . 0.0 110.614 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.506 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 14.2 t-80 -71.86 139.32 82.87 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.965 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.506 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 14.7 Cg_endo -55.97 -32.22 84.96 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 123.912 3.075 . . . . 0.0 114.424 -170.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.66 -28.92 65.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.794 0.33 . . . . 0.0 110.605 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.27 9.73 41.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.9 t-20 -104.5 134.28 19.75 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.8 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.73 -110.17 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.824 2.35 . . . . 0.0 113.489 -177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -97.67 -11.59 23.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -107.89 101.29 10.58 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.874 -176.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -98.94 -18.98 17.56 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.17 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -59.42 -47.61 84.82 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.416 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.9 p90 -72.06 -36.54 69.61 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.238 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.9 94.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.367 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HG3' ' HD2' ' A' ' 44' ' ' LYS . 6.7 pt-20 -68.9 -38.77 79.82 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.885 -178.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD2' ' HG3' ' A' ' 43' ' ' GLU . 12.7 mptt -68.61 -36.55 78.82 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.04 176.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 66.8 mmtt -64.71 -33.34 75.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -68.92 -39.94 79.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.328 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -62.59 -47.8 82.2 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.108 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 7.1 pt-20 -65.87 -44.08 86.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.314 -176.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 7.7 p -65.58 -38.34 82.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.237 -0.585 . . . . 0.0 111.144 -177.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.85 82.19 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.903 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -74.0 -41.31 62.08 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.157 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -74.44 -35.95 63.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.922 -173.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -69.18 -42.72 75.47 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 176.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -57.95 -48.49 79.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.809 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 52' ' ' ALA . 11.2 p -69.68 -41.64 80.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.598 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.731 HD22 ' HD3' ' A' ' 62' ' ' ARG . 2.9 tm? -73.91 -30.27 62.49 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.1 t -78.96 -17.57 55.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.153 -0.342 . . . . 0.0 110.861 -176.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.491 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 22.0 t70 -112.44 127.53 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.321 0.581 . . . . 0.0 110.504 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.41 -36.36 82.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.293 -175.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.51 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 73.6 t60 -68.37 -40.56 81.41 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.491 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 74.9 mmtt -61.17 -43.18 99.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.549 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.731 ' HD3' HD22 ' A' ' 56' ' ' LEU . 50.6 mtm105 -60.45 -45.08 94.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 178.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -60.9 -39.91 91.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.622 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.477 HG12 ' O ' ' A' ' 60' ' ' HIS . 33.8 mm -65.2 -44.26 95.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.078 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -61.59 -38.49 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.061 0.458 . . . . 0.0 110.516 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -64.99 -46.36 81.79 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.421 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.425 ' HD3' HD13 ' A' ' 64' ' ' ILE . 11.7 ptm180 -81.4 -28.44 34.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -176.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -93.49 -8.61 41.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.86 0.362 . . . . 0.0 110.799 -174.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -52.42 -50.53 47.24 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.703 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.07 -28.24 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.181 -0.509 . . . . 0.0 112.111 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.056 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.1 m . . . . . 0 C--O 1.226 -0.139 0 CA-C-O 121.343 0.592 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.831 ' HA ' HG12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -69.17 -38.01 78.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.293 -172.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.6 p90 -61.28 -33.27 73.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.147 173.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HG2' ' CE2' ' A' ' 5' ' ' TYR . 4.5 mt-10 -75.37 -44.21 46.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.626 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.831 HG12 ' HA ' ' A' ' 4' ' ' TYR . 11.0 pt -70.5 -40.33 77.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -169.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.486 HD13 HG23 ' A' ' 19' ' ' ILE . 18.5 mt -93.34 -75.61 0.49 Allowed 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.319 -176.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.0 t70 171.58 -24.48 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 O-C-N 124.338 1.024 . . . . 0.0 110.779 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 31.4 m -118.61 150.88 49.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.593 -170.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -91.36 -179.78 1.44 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.534 2.823 . . . . 0.0 113.067 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.658 ' HA ' ' HE2' ' A' ' 4' ' ' TYR . 32.9 mtm180 -60.14 -15.16 21.4 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.459 -167.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -82.18 -6.82 59.48 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.06 135.39 35.82 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.103 0.478 . . . . 0.0 111.044 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 t -81.05 166.11 21.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.619 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.31 -43.75 64.68 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -172.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 1.3 m-20 -65.74 -33.45 75.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.534 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -67.68 -40.49 84.41 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.486 HG23 HD13 ' A' ' 8' ' ' LEU . 1.8 mp -60.68 -41.52 88.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.056 173.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 36.4 ttmt -55.74 -43.71 76.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.18 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -69.37 -35.66 76.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.225 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.511 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -60.45 -42.51 96.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.082 0.468 . . . . 0.0 110.472 177.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.666 ' HD1' HG22 ' A' ' 49' ' ' VAL . 3.4 t80 -63.22 -43.23 98.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.864 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.406 ' O ' HD13 ' A' ' 28' ' ' LEU . 70.9 mtp180 -68.31 -44.17 76.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 10.1 ptm180 -66.1 -33.52 75.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.04 0.448 . . . . 0.0 110.492 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.622 ' HD3' ' HB ' ' A' ' 49' ' ' VAL . 35.7 tttp -70.42 -43.59 69.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.556 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.48 -47.74 81.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.566 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 24' ' ' ARG . 7.4 mp -62.88 -37.59 87.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.336 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.73 -30.17 71.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.975 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.591 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 59.1 m95 -108.46 17.56 21.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 111.479 -178.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -83.19 152.32 64.7 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 171.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -54.9 -27.04 51.63 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.845 3.03 . . . . 0.0 112.862 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.51 -34.79 77.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.36 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.14 -31.88 8.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.022 0.439 . . . . 0.0 111.554 -177.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -103.9 135.0 19.42 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 72.0 Cg_endo -71.12 -119.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.82 2.347 . . . . 0.0 114.589 -169.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.443 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 34.7 t70 -94.29 -7.65 41.3 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -167.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -93.55 101.64 13.82 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -94.52 -26.88 16.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -173.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.13 -46.51 88.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.273 -175.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.466 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 18.9 m-85 -72.96 -38.5 66.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.591 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.47 -46.15 89.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 3.1 pt-20 -70.29 -36.04 74.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.354 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.621 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 12.1 mmmt -58.83 -44.64 90.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.875 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 30.6 mmtp -66.84 -35.35 79.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.075 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -64.16 -40.25 95.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.296 174.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -67.01 -36.52 82.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.99 176.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 43.4 mm-40 -63.29 -44.69 94.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.014 0.435 . . . . 0.0 110.417 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.666 HG22 ' HD1' ' A' ' 23' ' ' TYR . 3.2 p -72.73 -37.38 55.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.92 177.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.62 -44.94 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.475 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.16 -42.85 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.05 0.453 . . . . 0.0 111.244 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.619 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -71.47 -34.84 70.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.392 0.615 . . . . 0.0 111.552 -176.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 28.0 t80 -71.58 -34.7 70.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.932 175.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.03 -49.99 75.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.119 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.836 HG23 ' HG3' ' A' ' 61' ' ' LYS . 7.1 p -65.18 -38.52 82.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.338 . . . . 0.0 110.737 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 56' ' ' LEU . 0.8 OUTLIER -73.73 -18.49 60.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.983 0.421 . . . . 0.0 110.96 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 t -78.27 -22.81 47.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.01 -174.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -112.15 124.56 52.7 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.15 -35.84 81.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.297 0.57 . . . . 0.0 110.98 -172.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.622 ' O ' HG12 ' A' ' 64' ' ' ILE . 48.9 t60 -70.6 -41.4 72.36 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.126 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.836 ' HG3' HG23 ' A' ' 55' ' ' VAL . 3.7 tppp? -61.87 -36.35 81.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.523 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -58.86 -46.55 87.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.516 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.1 pt-20 -71.71 -33.96 69.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.693 0.282 . . . . 0.0 110.343 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 60' ' ' HIS . 48.9 mm -64.51 -44.68 96.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 CA-C-O 121.129 0.49 . . . . 0.0 109.704 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 60.1 t80 -58.63 -41.99 87.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.874 178.295 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -72.85 -45.91 55.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.797 -175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 -86.72 -29.31 22.5 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -94.68 -7.23 41.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.126 0.489 . . . . 0.0 110.201 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 -37.45 94.55 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -60.7 -26.41 67.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.923 -1.138 . . . . 0.0 111.701 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.764 179.462 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 5' ' ' TYR . 3.1 m . . . . . 0 CA--C 1.533 0.31 0 CA-C-O 121.026 0.441 . . . . 0.0 111.065 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.618 ' O ' HG13 ' A' ' 7' ' ' ILE . 60.2 m-85 -68.31 -24.58 64.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.694 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . 0.515 ' CD1' ' HG2' ' A' ' 6' ' ' GLU . 4.3 p90 -57.63 -32.73 67.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.766 173.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 9.1 mm-40 -73.59 -44.32 57.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.021 0.438 . . . . 0.0 110.929 178.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.3 pp -71.11 -31.02 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.751 -174.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.418 HD21 HG23 ' A' ' 19' ' ' ILE . 61.1 tp -97.66 -79.94 0.46 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.601 -179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.637 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 25.1 t70 174.73 -40.56 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 30.1 m -121.72 157.49 56.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.527 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 5.9 Cg_exo -78.34 159.82 29.35 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.388 2.725 . . . . 0.0 112.486 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -62.44 -22.55 66.29 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.646 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -65.71 -17.97 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.277 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.98 146.46 43.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.819 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.8 t -59.61 156.67 13.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.07 -42.35 63.11 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -174.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -62.89 -34.57 77.68 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.71 -44.13 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.621 0.248 . . . . 0.0 111.112 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.418 HG23 HD21 ' A' ' 8' ' ' LEU . 2.0 mp -60.2 -44.61 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.338 0.589 . . . . 0.0 109.979 175.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -65.43 -36.98 85.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.471 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.829 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.076 176.761 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.54 -44.21 96.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.892 0.377 . . . . 0.0 110.756 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 1.1 t80 -57.98 -49.39 76.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.686 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 24' ' ' ARG . 25.9 mtp180 -68.0 -32.68 73.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.706 0.288 . . . . 0.0 111.176 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 22.3 ttm180 -63.75 -46.62 84.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.304 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -70.96 -40.85 71.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.067 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.27 -37.2 66.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.422 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -70.5 -36.86 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.473 178.606 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 13.1 mm-40 -63.31 -35.63 81.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.079 0.466 . . . . 0.0 110.616 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.437 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 29.4 m95 -105.75 19.0 21.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.651 -177.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.533 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.2 t-80 -72.3 141.41 83.34 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.533 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 13.4 Cg_endo -55.2 -31.06 74.37 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.844 3.029 . . . . 0.0 114.205 -168.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -70.61 -34.48 72.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.025 0.44 . . . . 0.0 111.183 177.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -90.26 -0.74 57.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.326 0.584 . . . . 0.0 110.08 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 26.8 t-20 -103.2 141.83 23.3 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.54 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 88.4 Cg_endo -74.89 -120.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.427 2.085 . . . . 0.0 112.695 -177.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.428 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 11.9 m-20 -100.15 -8.23 23.9 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -176.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -104.9 100.94 10.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.972 0.415 . . . . 0.0 110.467 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -96.88 -17.87 19.88 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.268 -177.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.453 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 6.6 tp10 -53.4 -46.93 69.91 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.451 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -73.47 -36.73 65.89 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.17 -45.78 91.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.742 0.306 . . . . 0.0 111.231 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 9.4 pt-20 -69.59 -37.64 77.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.496 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.644 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -60.56 -45.77 92.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.162 178.537 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -66.03 -39.28 90.06 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.281 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -59.04 -40.33 84.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.213 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.13 -40.97 82.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.716 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 13.4 mm-40 -63.64 -44.59 93.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.999 -176.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.61 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.3 p -72.26 -37.76 59.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.791 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.94 92.59 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.41 -38.85 68.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.981 0.42 . . . . 0.0 110.871 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.38 -36.95 71.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.666 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.77 -36.98 67.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.08 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.23 -47.49 85.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.571 HG23 ' HB3' ' A' ' 61' ' ' LYS . 9.0 p -69.78 -38.12 75.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.091 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.479 ' CD1' ' HB3' ' A' ' 4' ' ' TYR . 8.2 tt -71.59 -29.34 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -173.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -78.86 -19.38 52.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.669 0.271 . . . . 0.0 111.514 -174.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.483 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 21.7 t70 -113.13 133.38 55.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.292 0.568 . . . . 0.0 111.415 -176.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.536 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.96 -34.47 78.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.853 -177.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.448 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.3 m80 -68.96 -44.43 72.97 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.176 0.512 . . . . 0.0 110.124 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.571 ' HB3' HG23 ' A' ' 55' ' ' VAL . 14.1 mmmm -65.01 -37.94 89.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.566 -176.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 27.7 mtm180 -66.16 -45.58 80.44 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 -177.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 9.7 pt-20 -71.76 -32.71 67.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.893 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.605 HD13 ' HD3' ' A' ' 67' ' ' ARG . 30.1 mm -66.84 -36.01 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -63.18 -36.2 82.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.44 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -45.7 79.93 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.582 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.605 ' HD3' HD13 ' A' ' 64' ' ' ILE . 10.2 ptm180 -83.93 -47.13 11.35 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -94.65 -9.61 34.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.91 0.386 . . . . 0.0 111.239 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.59 -53.06 4.48 Favored Glycine 0 CA--C 1.507 -0.425 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.982 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 mmm-85 -61.18 -27.04 68.13 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.05 -0.575 . . . . 0.0 112.197 -177.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.614 -0.708 . . . . 0.0 110.609 -179.02 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . 0.451 ' O ' HG23 ' A' ' 7' ' ' ILE . 15.8 m . . . . . 0 C--O 1.226 -0.159 0 CA-C-O 121.083 0.468 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.696 ' OH ' HG12 ' A' ' 19' ' ' ILE . 1.0 OUTLIER -63.59 -37.37 87.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.087 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -67.5 -31.92 72.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.389 . . . . 0.0 110.677 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -73.23 -44.35 59.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.392 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.802 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.5 pp -70.43 -39.12 76.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.315 -175.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 ' HB3' ' A' ' 22' ' ' ALA . 38.0 tp -101.47 -82.27 0.47 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.12 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.9 t70 174.08 -29.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.029 -175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -119.56 155.44 54.35 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.098 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.19 -177.63 3.97 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.032 2.488 . . . . 0.0 112.656 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 53.7 mtp180 -78.64 -9.37 59.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.846 -174.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -74.3 -9.0 58.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.548 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.55 144.22 28.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.638 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.4 m -80.8 167.67 19.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.749 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.91 -43.11 65.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.679 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.42 -35.86 78.73 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.166 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.548 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 41.1 t0 -70.22 -43.76 69.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.306 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.696 HG12 ' OH ' ' A' ' 4' ' ' TYR . 1.2 mp -61.12 -41.76 90.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.743 175.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 58.0 mttm -55.6 -45.9 77.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.001 173.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -35.01 79.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.502 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.676 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -66.36 -43.9 84.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.842 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 3.4 p90 -66.43 -37.15 84.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.966 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 24' ' ' ARG . 26.5 mtp180 -57.2 -44.81 83.99 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 123.153 0.283 . . . . 0.0 111.164 177.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 7.2 ptm180 -67.3 -34.43 77.37 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.103 0.478 . . . . 0.0 110.427 -177.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -67.54 -38.42 84.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.121 175.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . 0.529 ' HA ' ' CE2' ' A' ' 30' ' ' TRP . . . -55.49 -40.64 71.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.306 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 28' ' ' LEU . 1.7 mm? -66.6 -35.9 81.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.055 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -62.39 -34.78 77.39 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.529 ' CE2' ' HA ' ' A' ' 27' ' ' ALA . 47.4 p-90 -105.14 12.27 32.22 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 110.745 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.611 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 16.4 t-80 -72.19 142.21 84.53 Favored Pre-proline 0 C--N 1.321 -0.662 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 15.0 Cg_endo -54.44 -27.95 51.9 Favored 'Trans proline' 0 N--CA 1.482 0.797 0 C-N-CA 124.111 3.207 . . . . 0.0 114.616 -168.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -70.65 -29.84 66.29 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.902 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -91.69 -46.15 8.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.883 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.456 ' O ' ' HA ' ' A' ' 32' ' ' PRO . 67.2 t30 -103.42 129.12 26.05 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 41.6 Cg_endo -91.1 -101.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.577 2.185 . . . . 0.0 115.103 -167.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -86.32 -8.56 57.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.821 0.343 . . . . 0.0 111.84 -168.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -94.85 99.9 11.88 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.828 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 0.9 OUTLIER -93.91 -18.38 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.964 178.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 8.5 tp10 -54.95 -46.12 74.96 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.121 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -72.14 -40.77 67.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.76 177.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HA ' ' HB2' ' A' ' 30' ' ' TRP . . . -62.38 -45.97 90.73 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.225 -174.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.0 pt-20 -71.71 -37.22 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.995 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -65.96 -40.29 91.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.671 -177.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 49' ' ' VAL . 67.1 mmtt -69.28 -35.31 75.91 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.258 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -59.24 -42.65 91.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.949 173.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -66.77 -42.84 85.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.763 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.28 -44.45 95.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.244 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 8.3 p -72.59 -37.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.304 -178.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -61.4 -45.94 92.24 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.14 -176.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 55' ' ' VAL . 13.2 pt-20 -72.15 -43.23 64.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.021 0.439 . . . . 0.0 110.897 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.802 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.5 -38.95 68.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.86 -173.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.572 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -70.99 -42.6 69.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.8 OUTLIER -58.64 -49.73 76.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.483 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.649 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.3 p -70.06 -45.17 77.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-N 116.343 -0.389 . . . . 0.0 112.003 -178.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.916 HD23 ' HD3' ' A' ' 62' ' ' ARG . 12.4 mt -74.87 -29.69 61.09 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.5 t -80.09 -18.36 50.17 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.682 -177.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -111.91 127.45 55.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.646 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -69.19 -28.85 66.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.235 -173.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' HG12 ' A' ' 64' ' ' ILE . 49.6 m80 -68.63 -43.17 76.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.46 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.649 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.8 OUTLIER -70.25 -38.26 75.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.481 -178.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.916 ' HD3' HD23 ' A' ' 56' ' ' LEU . 12.2 mmm180 -58.15 -38.19 76.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.968 175.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.447 ' O ' ' HD2' ' A' ' 67' ' ' ARG . 6.1 mm-40 -66.19 -42.91 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.383 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 60' ' ' HIS . 41.5 mm -64.01 -44.29 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.773 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HB2' HG21 ' A' ' 55' ' ' VAL . 52.0 t80 -67.08 -37.37 83.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.881 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -73.17 -46.3 51.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.024 0.44 . . . . 0.0 111.443 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 63' ' ' GLU . 4.1 ptm85 -81.28 -44.09 18.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.619 -173.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -94.89 -10.46 31.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -70.07 -49.56 33.41 Favored Glycine 0 CA--C 1.505 -0.57 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.649 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -65.2 -25.37 67.68 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.958 -0.621 . . . . 0.0 111.943 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 28.1 mm-40 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.042 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.8 m . . . . . 0 N--CA 1.468 0.453 0 N-CA-C 112.632 0.604 . . . . 0.0 112.632 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.575 ' O ' HG13 ' A' ' 7' ' ' ILE . 45.9 m-85 -68.37 -28.88 67.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.948 0.404 . . . . 0.0 111.114 -176.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -64.22 -32.46 74.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.006 0.432 . . . . 0.0 110.771 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.03 -43.84 51.32 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.313 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.4 pp -70.36 -37.83 72.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.34 -174.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -100.72 -84.62 0.43 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.8 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.818 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 31.8 t70 176.35 -33.24 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.426 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.3 m -119.99 156.77 54.16 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.145 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 86.6 Cg_endo -78.54 -177.49 3.93 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.92 2.413 . . . . 0.0 112.888 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -77.53 -21.78 52.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.041 0.448 . . . . 0.0 111.126 -178.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -78.76 1.79 21.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.582 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.57 145.79 27.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 0.0 110.737 177.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.1 t -70.51 160.84 31.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.79 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.43 -42.7 64.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 0.0 111.667 -174.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -61.62 -35.66 78.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.545 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -63.27 -45.77 89.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.4 HG12 ' CD2' ' A' ' 56' ' ' LEU . 2.0 mp -62.38 -45.63 98.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.339 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.71 -39.91 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.773 0.32 . . . . 0.0 111.0 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.776 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.91 -42.15 81.58 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 177.289 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.818 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.78 -43.48 98.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.958 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -62.16 -47.87 82.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.777 178.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.555 ' HG3' ' CE2' ' A' ' 23' ' ' TYR . 88.8 mtt180 -69.29 -39.32 78.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 5.0 ptp180 -63.0 -38.17 90.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.632 178.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HG3' ' HZ3' ' A' ' 30' ' ' TRP . 65.6 tttm -69.41 -40.75 77.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.221 0.534 . . . . 0.0 110.042 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.57 94.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.597 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.4 mp -71.56 -37.2 71.11 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -67.84 -28.59 67.69 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.608 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 12.5 m-90 -109.01 18.62 20.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.551 0.691 . . . . 0.0 110.698 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.498 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 54.6 t60 -74.06 142.87 79.84 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 172.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.765 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 11.3 Cg_endo -54.29 -28.92 55.07 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.504 2.802 . . . . 0.0 113.343 -173.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.45 -23.76 63.71 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.251 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -122.51 18.23 10.47 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.765 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -102.27 145.83 31.22 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.536 -175.701 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -81.79 -110.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 122.997 2.464 . . . . 0.0 113.421 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -93.48 -11.68 31.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.774 0.321 . . . . 0.0 111.524 -174.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 41' ' ' PHE . 7.3 p30 -106.92 114.71 28.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.95 0.405 . . . . 0.0 111.036 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 5.5 mptt -103.86 -32.3 9.36 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.59 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -66.93 -43.99 81.81 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.496 177.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.469 ' HB2' ' HB2' ' A' ' 38' ' ' ASN . 75.0 m-85 -72.33 -37.39 68.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.095 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -61.46 -45.41 94.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.795 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -67.65 -35.77 79.51 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.146 176.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.603 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -61.93 -40.87 97.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.467 177.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -63.87 -34.6 78.31 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.193 0.52 . . . . 0.0 109.666 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.77 -41.8 87.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.042 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -57.68 -44.9 86.12 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 44' ' ' LYS . 50.8 mt-10 -63.01 -45.6 91.59 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.054 0.454 . . . . 0.0 110.277 -177.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.616 HG22 ' HD1' ' A' ' 23' ' ' TYR . 9.7 p -70.88 -37.18 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.126 -172.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -63.9 -45.56 88.78 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.041 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -72.66 -41.81 65.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.066 0.46 . . . . 0.0 110.747 -179.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.548 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -73.14 -43.66 61.25 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.996 -174.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.477 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -66.97 -35.38 79.84 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.837 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 13.5 tp10 -60.73 -50.78 72.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.607 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.818 ' HA ' ' HD2' ' A' ' 61' ' ' LYS . 10.0 p -71.35 -39.55 72.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.582 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.436 HD23 ' O ' ' A' ' 56' ' ' LEU . 9.4 tt -72.83 -28.9 62.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -173.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -78.0 -15.33 59.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.409 -175.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 30.5 t70 -112.15 121.46 45.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.502 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -61.67 -34.33 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.549 -175.351 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -69.76 -44.5 70.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.776 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.818 ' HD2' ' HA ' ' A' ' 55' ' ' VAL . 22.8 ttmm -71.01 -43.37 68.1 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.915 -174.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 27.1 ptt180 -67.57 -38.57 84.3 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.511 -177.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 8.9 pt-20 -72.68 -36.39 67.88 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.498 177.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.91 -39.36 85.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.61 -35.32 80.63 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.007 0.432 . . . . 0.0 110.33 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -72.8 -48.9 34.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.896 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.23 -42.13 11.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -95.04 -10.67 30.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 0.0 110.359 -170.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.14 -46.58 93.69 Favored Glycine 0 CA--C 1.505 -0.54 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.695 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -61.9 -26.67 68.31 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.451 -0.874 . . . . 0.0 111.903 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.419 -177.566 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.0 m . . . . . 0 CA--C 1.53 0.202 0 N-CA-C 111.983 0.364 . . . . 0.0 111.983 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.736 ' HA ' HG12 ' A' ' 7' ' ' ILE . 34.1 m-85 -63.09 -28.06 69.82 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.296 0.57 . . . . 0.0 109.823 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -61.26 -37.62 83.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.205 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -74.0 -42.6 60.13 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.132 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.853 HD12 ' HB1' ' A' ' 52' ' ' ALA . 11.2 pt -70.98 -41.99 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.697 -172.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.55 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 15.6 mt -102.83 -74.82 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.015 0.436 . . . . 0.0 110.312 178.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.4 t70 172.07 -31.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.804 -173.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 25.1 m -120.98 150.62 53.59 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.831 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 10' ' ' VAL . 7.6 Cg_endo -87.5 -172.2 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.247 2.632 . . . . 0.0 112.968 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.497 ' HB3' ' CD2' ' A' ' 4' ' ' TYR . 15.7 ptm180 -68.31 -21.29 64.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.717 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p -67.94 -15.96 63.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.979 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.05 144.21 29.23 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.084 176.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 p -72.97 148.17 44.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.136 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.2 -31.08 41.14 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -167.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 2.9 m-20 -65.71 -35.27 80.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.37 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.39 -37.33 82.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.487 0.66 . . . . 0.0 109.433 176.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.428 HG23 HD13 ' A' ' 8' ' ' LEU . 1.7 mp -60.31 -46.78 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.2 175.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 17' ' ' ASP . 21.1 pttm -66.01 -33.86 76.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.004 0.431 . . . . 0.0 110.359 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 7.8 tptm -66.71 -41.63 87.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.377 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.596 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -61.68 -40.16 93.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.476 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -42.18 81.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.762 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -64.92 -38.18 90.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.991 0.424 . . . . 0.0 110.899 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -67.3 -44.38 79.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 22' ' ' ALA . 26.1 mtpp -62.83 -38.86 92.43 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.065 0.459 . . . . 0.0 109.804 176.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.17 -46.16 75.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.881 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.6 -36.93 73.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.038 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -62.07 -39.82 93.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.535 -176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.533 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 96.6 m95 -109.02 18.03 21.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.87 0.367 . . . . 0.0 111.87 -176.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.61 145.66 71.72 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 170.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 14.8 Cg_endo -55.27 -28.42 62.13 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.02 3.147 . . . . 0.0 113.695 -170.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.48 -29.26 69.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.958 0.408 . . . . 0.0 111.023 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -108.44 14.83 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.087 0.47 . . . . 0.0 110.329 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.572 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 28.6 t-20 -115.33 134.46 22.58 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -89.04 -107.81 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.838 2.359 . . . . 0.0 113.61 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.73 -10.22 23.45 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . 0.485 ' HB3' ' HD1' ' A' ' 41' ' ' PHE . 10.0 m120 -106.39 100.6 10.12 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.058 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -91.44 -28.66 17.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.315 -0.402 . . . . 0.0 109.993 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -56.4 -43.94 79.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.565 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 83.8 m-85 -66.99 -37.86 84.99 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.691 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . 0.533 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.46 -44.95 81.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.347 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -69.36 -37.96 77.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.594 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.737 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 9.2 mtpm? -65.28 -46.1 81.81 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.719 176.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -64.61 -34.51 78.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.472 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.74 -40.86 98.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.661 174.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.419 ' HE3' ' OE2' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -70.1 -33.94 72.49 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.435 176.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.737 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 17.3 mm-40 -63.8 -45.54 89.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 110.616 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.08 -36.13 61.78 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.181 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.67 -46.57 81.05 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.181 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 11.5 pt-20 -73.3 -43.54 60.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.109 0.481 . . . . 0.0 110.807 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.853 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -70.3 -38.92 75.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.718 -173.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -72.37 -37.82 68.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.308 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.16 -50.35 73.54 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.18 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.9 p -65.81 -42.74 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.0 tp -74.35 -29.24 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.6 t -79.74 -14.73 58.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.82 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.671 ' HB3' ' HD3' ' A' ' 61' ' ' LYS . 38.5 m-20 -109.68 121.37 45.06 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -66.03 -34.98 79.32 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.825 -173.154 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HA ' ' OE2' ' A' ' 63' ' ' GLU . 64.8 t60 -71.93 -38.13 69.9 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.337 177.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HD3' ' HB3' ' A' ' 58' ' ' ASP . 1.8 mptm? -68.69 -45.06 72.65 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.777 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HE ' ' HB2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -68.03 -33.91 75.49 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.457 -178.119 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.555 ' OE2' ' HA ' ' A' ' 60' ' ' HIS . 15.8 pt-20 -69.65 -37.0 76.59 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.552 -0.459 . . . . 0.0 109.835 177.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.0 mm -66.31 -44.09 91.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.062 175.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.61 -34.43 76.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.804 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.19 -47.13 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.6 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -89.4 -34.37 16.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -105.08 -4.1 22.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.221 0.534 . . . . 0.0 110.909 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.64 63.69 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.315 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -59.97 -37.57 79.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.005 -0.598 . . . . 0.0 111.848 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.627 -0.702 . . . . 0.0 111.088 -176.349 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.3 m . . . . . 0 C--O 1.232 0.147 0 CA-C-O 121.17 0.509 . . . . 0.0 110.698 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.681 ' HA ' HG13 ' A' ' 7' ' ' ILE . 60.9 m-85 -66.42 -27.97 68.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.468 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -63.99 -37.17 86.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.391 0.615 . . . . 0.0 109.553 175.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -73.14 -44.17 60.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.207 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.848 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.75 -37.8 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . 0.433 ' N ' HD12 ' A' ' 7' ' ' ILE . 34.9 tp -99.89 -87.81 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.504 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' LEU . 5.7 p-10 170.65 -11.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.212 0.605 . . . . 0.0 110.376 177.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 19' ' ' ILE . 19.8 m -119.95 151.67 52.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.502 174.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -90.31 -168.18 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.217 2.611 . . . . 0.0 113.639 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -78.53 -31.48 47.57 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 m -70.58 -7.29 42.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.995 0.426 . . . . 0.0 111.29 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.3 144.06 40.47 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.036 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.7 t -74.94 154.93 37.93 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.229 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.24 -41.12 62.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.92 0.391 . . . . 0.0 111.434 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.42 -34.41 77.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.578 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -68.85 -41.13 78.86 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.479 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.0 mp -60.66 -41.88 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.314 0.578 . . . . 0.0 109.692 172.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.413 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -59.15 -42.66 91.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.011 177.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -42.77 86.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.607 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.33 -41.47 93.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.567 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . 0.67 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -64.22 -42.02 96.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.921 175.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -65.03 -43.53 92.09 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 25.3 ptt180 -69.86 -39.21 76.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -64.54 -39.82 94.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.24 -39.26 92.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.122 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -40.29 90.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.066 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 26.9 mm-40 -62.85 -37.32 86.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.261 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . 0.43 ' CE3' ' HB3' ' A' ' 45' ' ' LYS . 13.2 m0 -110.18 19.42 18.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.086 0.47 . . . . 0.0 111.269 -176.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.71 141.2 82.07 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.58 -29.11 68.47 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.382 2.722 . . . . 0.0 112.362 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.22 -33.31 75.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.77 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -115.83 18.9 15.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.734 -173.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.46 ' OD1' ' HD2' ' A' ' 39' ' ' LYS . 26.8 t-20 -115.51 135.16 22.57 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.851 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 58.8 Cg_endo -88.12 -106.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.924 2.416 . . . . 0.0 114.05 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -97.06 -8.41 30.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -171.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -103.25 99.41 9.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 12.4 mmmm -101.99 -30.0 11.46 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.227 -171.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -61.33 -45.53 94.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.002 -174.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -72.04 -36.4 69.62 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.168 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.58 -44.3 96.66 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.727 0.298 . . . . 0.0 111.007 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.55 -42.3 74.77 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.081 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -70.16 -37.71 75.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.324 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 64.4 mmtt -68.26 -35.18 77.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.657 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -62.84 -39.71 95.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.694 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -65.53 -44.01 88.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.388 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -66.34 -42.62 87.86 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.77 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.67 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.0 p -66.11 -37.29 79.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.876 178.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -62.19 -45.44 93.37 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 111.599 -178.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.56 -37.65 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.071 0.462 . . . . 0.0 110.41 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.848 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.4 -39.29 59.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.085 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.528 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -72.12 -35.34 69.11 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 179.01 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -61.63 -48.11 82.34 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.577 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.63 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 14.3 p -65.63 -38.8 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.955 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.441 HD22 ' HB3' ' A' ' 4' ' ' TYR . 52.5 tp -72.67 -28.19 62.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 t -78.57 -20.09 51.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.989 0.423 . . . . 0.0 110.328 -176.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.751 ' HB2' ' HB2' ' A' ' 61' ' ' LYS . 73.1 m-20 -111.77 121.85 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.595 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 3.4 mppt? -67.2 -34.29 77.19 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' HG12 ' A' ' 64' ' ' ILE . 81.9 m-70 -69.73 -32.86 71.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.076 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.751 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.2 tppp? -71.41 -41.68 69.28 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.63 ' HG3' ' O ' ' A' ' 55' ' ' VAL . 25.7 mtp180 -61.98 -42.6 99.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.576 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 13.1 pt-20 -67.55 -33.12 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.202 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.6 mm -65.2 -44.11 95.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 175.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -59.15 -37.48 77.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.259 0.552 . . . . 0.0 109.876 175.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -72.27 -47.25 51.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.144 -176.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -88.49 -37.51 15.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.504 ' HA ' ' HG2' ' A' ' 71' ' ' GLU . 32.3 t80 -95.44 -9.49 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.877 0.37 . . . . 0.0 110.543 -173.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.69 -48.01 84.69 Favored Glycine 0 CA--C 1.51 -0.271 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.635 175.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.41 -25.98 68.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.473 -0.864 . . . . 0.0 111.465 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 68' ' ' TYR . 18.4 mm-40 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.07 -176.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.7 t . . . . . 0 CA--C 1.537 0.476 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' TYR . . . . . 0.575 ' CD1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -62.69 -38.08 88.97 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 122.002 -0.436 . . . . 0.0 111.32 -176.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 3.6 p90 -61.3 -32.14 71.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.034 174.781 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -73.71 -45.09 54.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.916 0.388 . . . . 0.0 111.077 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ILE . . . . . 0.782 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -71.72 -30.99 40.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.813 -176.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.0 tp -99.66 -87.03 0.37 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.424 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.75 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 23.9 t70 177.85 -33.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.038 0.447 . . . . 0.0 110.853 -174.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.02 156.52 56.77 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.417 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -92.99 174.48 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.487 2.791 . . . . 0.0 112.844 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.801 ' HD3' ' H ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -57.34 -22.67 43.9 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 114.711 -1.132 . . . . 0.0 113.842 -168.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 t -58.64 -24.12 60.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.925 0.393 . . . . 0.0 111.113 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.888 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -78.82 143.78 35.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.144 0.497 . . . . 0.0 111.719 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.7 t -78.54 164.66 24.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.658 173.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.14 -34.44 44.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.168 0.509 . . . . 0.0 111.451 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.99 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.813 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ASP . . . . . 0.888 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 11.3 t70 -69.34 -36.61 77.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.808 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.12 -43.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.995 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -65.13 -37.86 88.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.043 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.627 ' HA ' ' HE ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -70.24 -35.28 73.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.357 175.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.75 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -59.82 -42.09 92.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.26 0.552 . . . . 0.0 110.736 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.66 -40.85 96.13 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.408 173.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.627 ' HE ' ' HA ' ' A' ' 21' ' ' LYS . 9.9 mtm180 -67.19 -45.57 76.51 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.897 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 29' ' ' GLN . 1.6 ptm180 -64.81 -32.63 74.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.865 0.364 . . . . 0.0 110.336 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LYS . . . . . 0.518 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 0.6 OUTLIER -71.31 -38.89 71.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.126 0.489 . . . . 0.0 110.139 176.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.19 -37.09 66.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.74 171.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 8.1 mp -67.86 -35.72 79.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.423 175.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' A' ' 26' ' ' LYS . 50.9 mt-30 -62.24 -34.23 76.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.056 0.455 . . . . 0.0 110.295 177.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -106.39 18.72 21.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.504 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.558 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.42 152.05 94.07 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.445 -178.439 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PRO . . . . . 0.704 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 11.2 Cg_endo -54.92 -29.36 63.54 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.231 2.62 . . . . 0.0 112.791 -178.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.734 ' HB2' ' HD2' ' A' ' 34' ' ' LYS . 1.3 m-20 -60.92 -34.78 75.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.338 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LYS . . . . . 0.734 ' HD2' ' HB2' ' A' ' 33' ' ' ASP . 0.1 OUTLIER -108.11 18.06 21.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.719 -178.256 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ASN . . . . . 0.704 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.4 t-20 -116.18 136.27 22.98 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.097 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.433 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 53.1 Cg_endo -85.73 -121.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.947 2.432 . . . . 0.0 112.723 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . 0.433 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 43.7 m-20 -97.44 -9.17 27.77 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.894 0.378 . . . . 0.0 111.137 -177.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.34 101.95 11.46 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 51.4 mttm -99.42 -21.04 16.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -57.27 -42.89 82.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -67.35 -35.6 79.72 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.829 0.347 . . . . 0.0 110.309 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 24.3 mt-10 -69.44 -42.24 75.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 109.825 176.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 46.8 tptt -57.67 -46.7 83.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.705 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 65.1 mmtt -66.0 -35.49 80.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.29 -39.9 89.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.789 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 95.2 mttt -66.7 -44.21 82.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.222 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 16.5 mm-40 -65.11 -41.5 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 p -71.04 -37.3 66.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.603 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.15 92.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.607 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 9.6 pt-20 -71.36 -41.6 69.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.173 0.511 . . . . 0.0 110.372 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ALA . . . . . 0.782 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -68.65 -42.7 77.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.534 -174.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -38.31 71.35 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -69.89 -43.45 71.75 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.511 -175.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.605 HG22 ' HD2' ' A' ' 62' ' ' ARG . 11.8 p -68.27 -37.23 77.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.588 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 56' ' ' LEU . 1.9 tm? -72.17 -26.0 61.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.907 0.384 . . . . 0.0 110.327 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 t -76.32 -19.85 57.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.076 -174.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.624 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 23.1 t70 -112.36 121.63 45.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.42 0.629 . . . . 0.0 109.916 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.908 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.68 -37.22 85.88 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.99 -174.441 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 47.0 t60 -68.91 -39.54 79.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.287 -179.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . 0.624 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 41.5 mmtm -60.96 -36.15 78.64 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.219 177.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ARG . . . . . 0.605 ' HD2' HG22 ' A' ' 55' ' ' VAL . 9.8 mmm180 -63.81 -46.39 85.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.2 pt-20 -65.43 -38.85 91.12 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.718 -0.393 . . . . 0.0 109.983 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 ' HD3' ' A' ' 67' ' ' ARG . 44.5 mm -67.8 -44.09 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.551 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -60.93 -42.79 98.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.259 -176.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.29 -42.06 62.85 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . 0.522 ' HD3' HD13 ' A' ' 64' ' ' ILE . 8.0 ptm180 -72.17 -30.9 65.44 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 111.452 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.431 ' HB3' ' O ' ' A' ' 64' ' ' ILE . 0.1 OUTLIER -103.96 -6.13 21.54 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.421 0.629 . . . . 0.0 110.943 -174.446 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.47 -48.99 67.79 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.472 -0.785 . . . . 0.0 113.619 -178.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -58.4 -46.23 86.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -176.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.394 -0.813 . . . . 0.0 110.513 -179.521 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 N--CA 1.479 1.0 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -109.87 -44.68 3.77 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.011 0.434 . . . . 0.0 110.523 176.432 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 34.1 m 67.64 -7.12 0.6 Allowed 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.087 -0.96 . . . . 0.0 112.308 176.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.638 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 30.2 t80 -59.13 -35.34 73.3 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 111.886 0.328 . . . . 0.0 111.886 -177.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 70.2 t80 -56.82 -42.61 79.92 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.139 0.495 . . . . 0.0 110.21 177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 74.3 mm-40 -74.63 -45.09 47.22 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.601 -0.727 . . . . 0.0 111.928 -179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.901 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.2 pp -72.8 -40.88 61.32 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 N-CA-C 113.982 1.104 . . . . 0.0 113.982 -167.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -101.67 -106.08 0.25 Allowed 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.322 -169.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.461 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 26.6 t70 -140.53 -35.71 0.49 Allowed 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.84 -171.315 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.542 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 31.6 m -129.79 162.08 55.62 Favored Pre-proline 0 C--N 1.326 -0.43 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.693 -179.274 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.542 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.8 Cg_endo -62.11 160.78 28.84 Favored 'Trans proline' 0 C--N 1.349 0.584 0 C-N-CA 123.589 2.859 . . . . 0.0 113.108 175.458 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -79.6 106.74 11.85 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.909 0.861 . . . . 0.0 109.182 175.679 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 22.8 t -176.65 -37.21 0.01 OUTLIER 'General case' 0 C--N 1.312 -1.046 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 -174.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.53 145.59 47.35 Favored 'General case' 0 N--CA 1.443 -0.779 0 CA-C-N 114.581 -1.19 . . . . 0.0 110.086 173.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -68.08 165.74 17.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.261 -0.427 . . . . 0.0 111.19 -177.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.577 ' HA ' HD13 ' A' ' 19' ' ' ILE . . . -51.88 -30.11 22.66 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-O 121.074 0.464 . . . . 0.0 111.843 -178.238 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -58.5 -44.39 89.4 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.742 -0.663 . . . . 0.0 110.441 179.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -68.84 -34.99 76.39 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.212 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.631 HG13 ' CZ ' ' A' ' 4' ' ' TYR . 1.9 mp -57.54 -47.8 84.43 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 CA-C-N 116.223 -0.444 . . . . 0.0 110.673 176.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -65.83 -38.29 88.5 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.056 0.455 . . . . 0.0 110.126 178.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HD3' ' O ' ' A' ' 21' ' ' LYS . 1.2 tmtt? -69.68 -35.42 75.11 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.753 -0.658 . . . . 0.0 110.733 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.554 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -63.85 -35.86 82.01 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-O 120.929 0.395 . . . . 0.0 110.462 176.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.682 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -64.01 -48.04 77.9 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.897 -0.592 . . . . 0.0 110.188 173.456 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 71.9 mtp180 -64.68 -43.25 94.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.193 -0.458 . . . . 0.0 111.357 -178.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.554 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 8.9 ptp85 -65.21 -39.96 93.5 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.719 0.295 . . . . 0.0 110.439 -177.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.498 ' HA ' ' HB3' ' A' ' 29' ' ' GLN . 24.1 ttmm -71.73 -35.81 70.27 Favored 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.334 -0.394 . . . . 0.0 110.573 178.575 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.87 -44.96 74.51 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.771 -0.649 . . . . 0.0 111.189 174.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.586 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 10.7 mp -71.48 -34.81 70.51 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-O 120.965 0.412 . . . . 0.0 110.782 175.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.498 ' HB3' ' HA ' ' A' ' 26' ' ' LYS . 33.5 tt0 -61.66 -36.82 81.94 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.393 179.095 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.558 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 95.3 m95 -111.85 19.35 18.04 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.342 0.592 . . . . 0.0 110.82 178.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.612 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 27.7 t60 -72.14 145.04 88.07 Favored Pre-proline 0 C--N 1.322 -0.61 0 N-CA-C 108.655 -0.869 . . . . 0.0 108.655 178.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.612 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.4 Cg_endo -54.21 -28.73 53.36 Favored 'Trans proline' 0 C--N 1.352 0.725 0 C-N-CA 123.866 3.044 . . . . 0.0 113.633 -174.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -67.38 -25.17 65.83 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.123 0.487 . . . . 0.0 110.134 177.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.72 2.59 21.92 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.772 -0.649 . . . . 0.0 111.117 -175.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.602 HD21 ' HG3' ' A' ' 39' ' ' LYS . 0.2 OUTLIER -104.04 140.29 20.93 Favored Pre-proline 0 C--N 1.327 -0.374 0 CA-C-O 120.939 0.399 . . . . 0.0 110.216 -176.108 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.409 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 62.6 Cg_endo -87.34 -119.52 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.453 0 C-N-CA 123.047 2.498 . . . . 0.0 112.757 -178.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.409 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 4.0 m-20 -86.91 -8.05 57.61 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.114 0.483 . . . . 0.0 111.157 -177.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.569 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 55.1 m-80 -102.47 102.95 13.29 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.242 -179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.602 ' HG3' HD21 ' A' ' 35' ' ' ASN . 0.1 OUTLIER -97.77 -31.07 12.43 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 116.156 -0.474 . . . . 0.0 109.949 -179.998 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 tm-20 -61.75 -44.88 96.03 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.205 -176.179 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.569 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 82.6 m-85 -66.79 -37.43 84.55 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.448 179.229 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.558 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -68.15 -45.99 72.04 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.42 -0.354 . . . . 0.0 111.029 -178.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.3 pt-20 -70.3 -36.22 74.2 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 120.911 -0.316 . . . . 0.0 110.546 178.17 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.407 ' HA ' ' HE3' ' A' ' 47' ' ' LYS . 8.5 ttmm -59.53 -44.44 93.17 Favored 'General case' 0 N--CA 1.449 -0.487 0 CA-C-O 120.864 0.364 . . . . 0.0 110.147 178.44 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.544 ' O ' HG12 ' A' ' 49' ' ' VAL . 62.9 mmtt -68.12 -39.64 82.72 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 115.939 -0.573 . . . . 0.0 110.828 179.221 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -62.44 -41.59 98.83 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.099 -0.501 . . . . 0.0 110.377 177.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.407 ' HE3' ' HA ' ' A' ' 44' ' ' LYS . 51.3 mtmt -68.34 -44.11 76.0 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.908 -0.587 . . . . 0.0 111.749 -179.751 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.533 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 12.7 pt-20 -72.27 -36.28 68.97 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 111.871 0.323 . . . . 0.0 111.871 -177.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.682 HG21 ' HA ' ' A' ' 23' ' ' TYR . 7.8 p -67.21 -38.38 80.93 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 C-N-CA 120.175 -0.61 . . . . 0.0 110.085 177.279 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.84 -44.46 96.79 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.497 -0.319 . . . . 0.0 111.368 179.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.457 ' HG2' ' HA ' ' A' ' 48' ' ' GLU . 11.5 pt-20 -72.7 -40.66 66.02 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-O 120.967 0.413 . . . . 0.0 111.083 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.901 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.04 -40.03 68.67 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.918 -0.583 . . . . 0.0 111.454 -175.011 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.516 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -69.28 -34.23 74.41 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.283 -0.636 . . . . 0.0 109.283 175.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -60.46 -50.26 74.28 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.901 179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.606 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 3.2 m -67.93 -40.98 84.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.678 0 N-CA-C 111.913 0.338 . . . . 0.0 111.913 -178.051 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.5 HD23 HG12 ' A' ' 19' ' ' ILE . 31.1 tp -73.1 -28.83 62.5 Favored 'General case' 0 C--N 1.325 -0.457 0 C-N-CA 120.169 -0.612 . . . . 0.0 112.06 -175.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 35.9 t -77.98 -22.63 49.1 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 120.784 0.326 . . . . 0.0 110.228 -177.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.826 ' HB3' ' HG3' ' A' ' 61' ' ' LYS . 11.7 t70 -112.41 121.67 45.51 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.082 0.468 . . . . 0.0 109.747 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.594 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 3.0 mptp? -66.56 -34.99 79.14 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.806 -0.634 . . . . 0.0 111.005 -170.175 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.514 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.5 t-80 -69.68 -42.16 74.5 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.517 178.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.826 ' HG3' ' HB3' ' A' ' 58' ' ' ASP . 4.6 mtpt -60.49 -33.76 73.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.659 -0.246 . . . . 0.0 111.623 179.108 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.606 ' HG2' ' O ' ' A' ' 55' ' ' VAL . 14.9 mtm105 -60.63 -46.67 89.42 Favored 'General case' 0 CA--C 1.521 -0.168 0 CA-C-O 121.03 0.443 . . . . 0.0 110.654 -178.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 14.8 pt-20 -71.84 -30.12 65.13 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 116.005 -0.543 . . . . 0.0 110.592 -176.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.823 HD13 ' HD3' ' A' ' 67' ' ' ARG . 47.8 mm -63.65 -38.02 81.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.131 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 175.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 35.4 t80 -65.24 -39.92 93.33 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 115.509 -0.769 . . . . 0.0 110.277 178.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 28.1 m-20 -72.83 -45.73 56.8 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 111.915 0.339 . . . . 0.0 111.915 179.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.823 ' HD3' HD13 ' A' ' 64' ' ' ILE . 9.0 ptm180 -71.61 -41.71 68.56 Favored 'General case' 0 N--CA 1.463 0.191 0 O-C-N 122.33 -0.231 . . . . 0.0 111.388 -176.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -92.01 -0.46 57.47 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.512 0.673 . . . . 0.0 109.773 -174.216 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.59 -48.76 8.66 Favored Glycine 0 N--CA 1.438 -1.168 0 N-CA-C 109.772 -1.331 . . . . 0.0 109.772 166.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 29.1 mmm180 -65.75 -45.51 82.32 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 114.431 -0.885 . . . . 0.0 111.585 175.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 . . . . . 0 C--O 1.247 0.944 0 CA-C-O 118.529 -0.748 . . . . 0.0 110.953 179.146 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 54.2 ttp . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 120.646 0.26 . . . . 0.0 110.406 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -75.37 -36.34 60.95 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.769 0.318 . . . . 0.0 111.247 -177.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 17.1 m 66.62 -2.28 1.11 Allowed 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.61 -0.723 . . . . 0.0 112.225 176.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.503 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 0.0 OUTLIER -61.32 -36.85 81.27 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.229 0.538 . . . . 0.0 110.862 -178.964 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.551 ' CD2' ' HG2' ' A' ' 6' ' ' GLU . 2.1 p90 -57.35 -39.3 75.65 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.153 175.448 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.551 ' HG2' ' CD2' ' A' ' 5' ' ' TYR . 8.0 mm-40 -73.88 -44.36 55.61 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.419 -0.355 . . . . 0.0 111.463 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.52 HD11 HD11 ' A' ' 56' ' ' LEU . 2.3 pp -71.15 -31.73 45.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.143 -0.48 . . . . 0.0 111.715 -173.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 59.7 tp -97.39 -78.37 0.48 Allowed 'General case' 0 C--O 1.235 0.315 0 C-N-CA 121.114 -0.235 . . . . 0.0 110.801 -177.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 12.0 t70 177.56 -44.01 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 121.251 0.548 . . . . 0.0 110.222 -175.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.423 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 27.5 m -120.5 156.14 55.92 Favored Pre-proline 0 C--N 1.324 -0.541 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.642 -170.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.475 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 87.1 Cg_endo -81.74 174.66 10.13 Favored 'Trans proline' 0 C--N 1.347 0.485 0 C-N-CA 123.201 2.6 . . . . 0.0 112.042 176.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.411 ' HG2' ' H ' ' A' ' 12' ' ' ARG . 7.3 ptm85 -78.05 -8.92 58.82 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 115.884 -0.598 . . . . 0.0 112.392 -174.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 10.5 m -69.35 -13.85 62.6 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.082 0.467 . . . . 0.0 110.776 176.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.98 144.27 28.42 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.6 178.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 m -72.74 163.59 27.86 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.738 179.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.28 -40.14 61.38 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 112.227 0.454 . . . . 0.0 112.227 -173.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -61.15 -34.52 75.14 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.358 -178.403 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 21.1 t70 -69.66 -40.03 76.68 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.983 -0.376 . . . . 0.0 109.983 -179.106 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 2.3 mp -61.81 -40.93 88.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.094 -0.503 . . . . 0.0 109.825 172.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.887 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 26.7 ttpp -57.59 -43.33 84.58 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.606 -0.725 . . . . 0.0 110.556 175.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.781 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.2 mmpt? -63.54 -35.98 82.26 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.537 174.811 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.521 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.55 -47.88 77.15 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -176.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.887 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 12.4 p90 -70.09 -36.93 75.26 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 119.894 -0.722 . . . . 0.0 109.849 177.303 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.41 ' O ' HD13 ' A' ' 28' ' ' LEU . 1.8 mmt180 -57.52 -45.7 84.69 Favored 'General case' 0 N--CA 1.448 -0.535 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.893 -179.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.521 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 6.3 ptp180 -67.07 -39.18 86.79 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 120.797 0.332 . . . . 0.0 110.514 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 3.8 ttmp? -64.76 -38.27 90.42 Favored 'General case' 0 CA--C 1.53 0.188 0 CA-C-O 121.341 0.591 . . . . 0.0 110.228 176.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -61.92 -36.27 80.86 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.441 -0.799 . . . . 0.0 111.074 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.483 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 6.4 mp -69.68 -36.21 75.81 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.404 179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 49.5 mt-30 -62.23 -37.4 85.25 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.447 -0.342 . . . . 0.0 111.769 -179.706 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 5.0 m-90 -108.22 20.27 18.87 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-O 120.808 0.337 . . . . 0.0 111.064 179.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.526 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 3.2 t-80 -72.02 140.67 83.38 Favored Pre-proline 0 C--N 1.326 -0.442 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -178.343 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.526 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 9.3 Cg_endo -53.07 -37.28 79.02 Favored 'Trans proline' 0 C--N 1.345 0.359 0 C-N-CA 122.731 2.287 . . . . 0.0 113.327 -167.028 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.0 p-10 -67.88 -26.49 66.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.044 0.45 . . . . 0.0 111.162 -178.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.451 ' HA ' ' HD3' ' A' ' 34' ' ' LYS . 12.9 mmtp -107.34 15.12 25.31 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.498 -179.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -107.76 134.33 20.1 Favored Pre-proline 0 C--N 1.322 -0.607 0 CA-C-N 115.667 -0.697 . . . . 0.0 109.365 179.102 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.42 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 95.7 Cg_endo -81.26 -120.92 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.487 0 C-N-CA 122.951 2.434 . . . . 0.0 113.251 -175.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.42 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 20.9 m-20 -97.04 -9.33 28.34 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.852 0.358 . . . . 0.0 111.613 -173.208 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.451 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.9 m120 -100.69 101.62 12.54 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 177.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.578 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 0.5 OUTLIER -93.53 -29.63 15.42 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 116.342 -0.39 . . . . 0.0 111.314 -174.581 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -54.43 -44.84 72.77 Favored 'General case' 0 C--N 1.326 -0.454 0 O-C-N 123.549 0.531 . . . . 0.0 110.979 -174.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.463 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 89.9 m-85 -62.61 -43.11 99.63 Favored 'General case' 0 C--N 1.321 -0.657 0 CA-C-N 115.763 -0.653 . . . . 0.0 111.03 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.82 -44.84 96.37 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.577 -0.283 . . . . 0.0 111.016 -179.004 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.578 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 15.7 mt-10 -69.56 -44.14 71.48 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.024 0.44 . . . . 0.0 110.361 -179.052 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -64.98 -41.48 95.4 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.287 -178.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.463 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 66.5 mmtt -71.69 -34.57 69.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 120.661 0.267 . . . . 0.0 110.333 179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -60.76 -39.27 88.11 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.085 0.469 . . . . 0.0 109.751 174.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt -64.94 -45.77 84.41 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.488 174.718 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -63.74 -43.93 95.03 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.467 -177.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.511 ' CG2' ' HB2' ' A' ' 23' ' ' TYR . 11.2 p -67.35 -36.72 77.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 C-N-CA 120.785 -0.366 . . . . 0.0 110.782 179.75 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.695 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . . . -63.87 -45.77 87.93 Favored 'General case' 0 C--O 1.238 0.466 0 CA-C-O 120.91 0.386 . . . . 0.0 111.74 -177.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -70.69 -36.8 73.47 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-O 121.544 0.688 . . . . 0.0 109.979 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.662 ' O ' ' HG ' ' A' ' 56' ' ' LEU . . . -73.97 -45.94 47.06 Favored 'General case' 0 N--CA 1.441 -0.876 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.662 -176.453 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.695 ' CD2' ' HA ' ' A' ' 50' ' ' ALA . 1.0 OUTLIER -63.13 -34.77 78.34 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.47 -0.567 . . . . 0.0 109.47 -177.998 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -62.21 -51.24 68.57 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-N 115.369 -0.832 . . . . 0.0 110.322 178.034 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.446 HG12 ' HA ' ' A' ' 52' ' ' ALA . 14.6 p -71.84 -39.09 67.29 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.543 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -178.546 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.662 ' HG ' ' O ' ' A' ' 52' ' ' ALA . 46.6 mt -68.47 -24.29 64.68 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -172.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 14.8 t -78.3 -23.11 47.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.907 0.385 . . . . 0.0 110.36 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -114.33 121.58 44.06 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-O 121.091 0.472 . . . . 0.0 111.027 -177.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.476 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.28 -36.25 83.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.68 -0.691 . . . . 0.0 111.691 -178.064 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.443 ' N ' ' HG2' ' A' ' 59' ' ' LYS . 32.2 m-70 -69.14 -41.86 76.76 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.195 -0.912 . . . . 0.0 110.853 178.02 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.433 ' HE3' ' HB2' ' A' ' 61' ' ' LYS . 26.7 ttmt -63.09 -33.78 76.18 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.07 178.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 7.1 mmm180 -62.13 -37.14 84.01 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.821 174.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.416 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 41.5 mt-10 -63.38 -43.08 98.62 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.114 0.483 . . . . 0.0 110.175 178.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.14 -44.93 95.39 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.575 178.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -66.19 -35.36 80.24 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.989 -0.55 . . . . 0.0 111.19 -178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -67.8 -47.38 69.25 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 116.617 -0.265 . . . . 0.0 110.984 -176.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -82.67 -41.28 19.58 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 112.378 0.511 . . . . 0.0 112.378 -177.95 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -93.19 9.91 34.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 121.561 0.696 . . . . 0.0 110.112 -171.666 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -87.03 -47.59 4.68 Favored Glycine 0 N--CA 1.442 -0.936 0 N-CA-C 110.316 -1.114 . . . . 0.0 110.316 169.886 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -66.7 -42.36 86.57 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 114.366 -0.917 . . . . 0.0 110.659 177.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 . . . . . 0 C--O 1.246 0.921 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.132 -178.779 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.9 ttt . . . . . 0 N--CA 1.478 0.944 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.459 ' HB1' ' CD2' ' A' ' 4' ' ' TYR . . . 70.59 -72.69 0.11 Allowed 'General case' 0 N--CA 1.467 0.393 0 CA-C-N 115.658 -0.701 . . . . 0.0 111.675 179.135 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 35.5 m 60.06 26.59 15.94 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.98 0.419 . . . . 0.0 111.665 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.517 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 60.2 m-85 -68.5 -33.71 74.61 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.112 0.482 . . . . 0.0 110.458 179.336 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 38.2 t80 -62.79 -35.07 78.65 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.518 175.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.8 mm-40 -74.55 -43.97 53.23 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 115.303 -0.862 . . . . 0.0 112.138 179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.669 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -69.51 -40.96 80.32 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 N-CA-C 111.877 0.325 . . . . 0.0 111.877 -174.067 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.406 ' N ' HD12 ' A' ' 7' ' ' ILE . 32.6 tp -102.58 -104.02 0.28 Allowed 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 120.421 -0.512 . . . . 0.0 111.011 177.376 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.553 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 7.2 m-20 -158.48 -22.65 0.08 Allowed 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.125 -177.223 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.4 m -118.48 158.52 46.74 Favored Pre-proline 0 C--N 1.326 -0.449 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.647 -176.586 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.618 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 18.3 Cg_endo -59.3 -81.79 0.01 OUTLIER 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.079 2.519 . . . . 0.0 114.118 -172.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.474 ' HA ' HD11 ' A' ' 56' ' ' LEU . 37.8 ptt180 -171.32 -35.88 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 111.593 0.22 . . . . 0.0 111.593 -177.393 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.5 t -97.25 27.41 4.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 121.304 0.573 . . . . 0.0 110.455 179.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.44 145.92 30.52 Favored 'General case' 0 N--CA 1.444 -0.735 0 CA-C-N 116.019 -0.537 . . . . 0.0 110.497 178.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.5 m -55.37 128.58 34.89 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 175.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.599 ' O ' ' HG2' ' A' ' 20' ' ' LYS . . . -53.23 -33.75 54.22 Favored 'General case' 0 N--CA 1.462 0.142 0 N-CA-C 113.215 0.821 . . . . 0.0 113.215 -170.644 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -62.75 -34.8 77.95 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.878 0.371 . . . . 0.0 110.753 178.57 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 24.0 t70 -68.82 -35.81 77.43 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.957 -0.565 . . . . 0.0 109.754 179.052 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.802 HG21 ' HB2' ' A' ' 57' ' ' SER . 2.4 mp -59.72 -42.68 89.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 115.846 -0.616 . . . . 0.0 109.733 170.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.599 ' HG2' ' O ' ' A' ' 16' ' ' ALA . 71.0 mmtt -61.22 -37.91 84.72 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.562 175.384 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.604 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.63 -47.44 78.54 Favored 'General case' 0 C--O 1.224 -0.241 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.26 176.749 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.553 ' HB1' ' HB2' ' A' ' 9' ' ' ASP . . . -60.63 -39.57 88.76 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.136 0.494 . . . . 0.0 110.466 179.729 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.528 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.7 OUTLIER -67.57 -50.0 60.52 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.518 -0.765 . . . . 0.0 111.486 176.684 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtt85 -68.36 -37.78 80.79 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 111.978 0.362 . . . . 0.0 111.978 -177.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.424 HH11 ' HD3' ' A' ' 25' ' ' ARG . 8.4 ttt-85 -62.12 -44.44 96.64 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-O 120.973 0.416 . . . . 0.0 110.742 175.226 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.635 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.2 ttmm -66.46 -42.34 87.71 Favored 'General case' 0 N--CA 1.448 -0.569 0 CA-C-O 121.381 0.61 . . . . 0.0 110.078 -179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -62.65 -36.99 84.61 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.092 -0.958 . . . . 0.0 111.293 176.476 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.439 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -66.86 -37.05 83.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.538 -177.98 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -64.12 -34.82 78.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.907 0.384 . . . . 0.0 110.925 -179.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.407 ' HB3' ' HA ' ' A' ' 42' ' ' ALA . 99.1 m95 -106.45 19.3 20.7 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.288 0.566 . . . . 0.0 110.546 179.664 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.512 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.27 152.2 94.38 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.476 -0.783 . . . . 0.0 109.356 -178.427 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.512 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 11.1 Cg_endo -54.81 -30.09 66.01 Favored 'Trans proline' 0 C--N 1.344 0.298 0 C-N-CA 122.492 2.128 . . . . 0.0 112.074 -179.323 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -70.8 -24.38 62.55 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.899 178.632 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -115.43 -3.42 12.42 Favored 'General case' 0 C--N 1.33 -0.276 0 N-CA-C 112.524 0.564 . . . . 0.0 112.524 -173.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.438 ' HA ' ' HD3' ' A' ' 36' ' ' PRO . 29.9 p30 -103.54 140.25 20.88 Favored Pre-proline 0 C--N 1.325 -0.464 0 CA-C-O 121.262 0.554 . . . . 0.0 110.458 -176.12 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.438 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 55.5 Cg_endo -92.19 -104.5 0.0 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.148 0 C-N-CA 123.155 2.57 . . . . 0.0 112.85 -177.863 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 31.9 m-20 -98.12 -7.21 30.03 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.84 0.352 . . . . 0.0 111.854 -176.445 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 57.0 m-80 -94.34 100.91 12.86 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-O 121.036 0.446 . . . . 0.0 110.182 179.056 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 35.2 mmtp -101.63 -29.54 11.87 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.904 -0.589 . . . . 0.0 109.52 178.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 12.4 tt0 -58.85 -43.6 90.79 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.047 -0.979 . . . . 0.0 110.227 179.033 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -71.02 -37.48 72.62 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.627 178.603 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.407 ' HA ' ' HB3' ' A' ' 30' ' ' TRP . . . -63.5 -43.87 95.98 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.053 -0.522 . . . . 0.0 110.949 -179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.577 ' O ' ' HG3' ' A' ' 47' ' ' LYS . 10.2 pt-20 -69.55 -38.94 77.68 Favored 'General case' 0 N--CA 1.455 -0.177 0 C-N-CA 120.579 -0.448 . . . . 0.0 110.323 178.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -59.76 -47.8 84.23 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-O 120.684 0.278 . . . . 0.0 110.949 177.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.502 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 67.1 mmtt -65.09 -35.22 80.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.687 -178.144 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.5 t80 -67.08 -40.73 87.05 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.905 -0.588 . . . . 0.0 110.475 178.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.577 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 88.2 mttt -68.36 -46.52 69.87 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 116.356 -0.384 . . . . 0.0 110.983 -179.449 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.502 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 11.9 pt-20 -67.29 -37.49 83.49 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 116.421 -0.354 . . . . 0.0 111.376 -175.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.635 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 14.7 p -71.8 -37.72 63.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 C-N-CA 120.199 -0.6 . . . . 0.0 110.334 178.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -44.37 94.59 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 121.072 -0.251 . . . . 0.0 111.336 -178.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -71.96 -40.92 68.31 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-O 121.19 0.519 . . . . 0.0 110.603 -179.326 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.669 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.2 -38.93 60.54 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.73 -0.668 . . . . 0.0 112.083 -175.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.518 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.5 -35.75 68.23 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 178.983 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -63.45 -45.55 90.35 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 116.437 -0.347 . . . . 0.0 110.399 -179.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.745 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 11.1 p -70.23 -41.07 78.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.3 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.738 -179.73 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.474 HD11 ' HA ' ' A' ' 12' ' ' ARG . 58.4 tp -74.31 -30.93 62.28 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 112.59 0.589 . . . . 0.0 112.59 -176.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . 0.802 ' HB2' HG21 ' A' ' 19' ' ' ILE . 32.1 t -81.72 -21.17 38.13 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 120.731 0.301 . . . . 0.0 110.98 -176.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.555 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 20.2 t70 -111.83 124.46 52.42 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 116.392 -0.367 . . . . 0.0 110.85 -174.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.516 ' O ' ' HG3' ' A' ' 63' ' ' GLU . 0.1 OUTLIER -66.93 -32.19 73.27 Favored 'General case' 0 N--CA 1.45 -0.442 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.581 -174.858 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.505 ' O ' HG12 ' A' ' 64' ' ' ILE . 43.0 m-70 -68.39 -41.89 79.85 Favored 'General case' 0 CA--C 1.518 -0.269 0 N-CA-C 110.083 -0.339 . . . . 0.0 110.083 177.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.745 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 5.9 mptp? -61.51 -36.71 81.29 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.568 174.349 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.555 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 46.8 mmm-85 -59.94 -40.8 90.17 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-O 121.059 0.457 . . . . 0.0 109.842 174.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.516 ' HG3' ' O ' ' A' ' 59' ' ' LYS . 44.1 mt-10 -65.22 -40.17 93.75 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.8 -0.636 . . . . 0.0 109.996 175.436 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.505 HG12 ' O ' ' A' ' 60' ' ' HIS . 42.4 mm -64.43 -44.45 97.06 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.776 -179.127 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 67.6 t80 -64.05 -37.33 87.03 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.914 0.388 . . . . 0.0 110.501 179.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -62.08 -45.09 95.07 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.075 -178.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.4 ptm180 -88.73 -48.05 7.79 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -177.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -94.64 -9.74 34.03 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.861 0.362 . . . . 0.0 111.248 -170.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.16 -44.63 97.46 Favored Glycine 0 CA--C 1.506 -0.479 0 N-CA-C 111.198 -0.761 . . . . 0.0 111.198 175.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -66.7 -34.28 77.5 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 114.25 -0.975 . . . . 0.0 111.559 175.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 . . . . . 0 C--O 1.247 0.96 0 CA-C-O 118.788 -0.625 . . . . 0.0 110.957 -177.569 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtt . . . . . 0 N--CA 1.482 1.145 0 CA-C-O 120.772 0.32 . . . . 0.0 110.692 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 56.68 72.65 0.49 Allowed 'General case' 0 C--O 1.232 0.182 0 CA-C-N 115.771 -0.65 . . . . 0.0 112.047 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 50.4 m -68.75 3.62 1.83 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-O 121.411 0.625 . . . . 0.0 110.793 175.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.579 ' HA ' HG13 ' A' ' 7' ' ' ILE . 98.7 m-85 -68.79 -23.86 64.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.559 176.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 36.3 t80 -56.59 -33.01 65.8 Favored 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 21.5 mm-40 -73.0 -44.37 61.11 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.608 -0.723 . . . . 0.0 111.411 -179.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.851 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.8 -39.18 67.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.826 -176.254 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.491 ' N ' HD12 ' A' ' 7' ' ' ILE . 38.4 tp -100.59 -90.56 0.32 Allowed 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 110.297 -0.26 . . . . 0.0 110.297 178.323 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 4.6 p30 171.1 -16.04 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.513 0.725 . . . . 0.0 109.924 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.3 m -120.98 152.46 56.48 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.975 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -87.59 165.49 7.76 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 C-N-CA 122.907 2.405 . . . . 0.0 112.524 -179.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.808 ' HB3' HD11 ' A' ' 56' ' ' LEU . 11.0 ptm180 -70.15 -3.91 18.98 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.449 -0.796 . . . . 0.0 112.472 -174.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 13.5 t -56.02 -33.5 64.97 Favored 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.261 172.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.401 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -76.34 146.03 39.09 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.85 -0.613 . . . . 0.0 110.423 177.736 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 2.8 p -63.76 155.81 29.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.356 -0.384 . . . . 0.0 111.231 177.579 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.3 -42.84 64.11 Favored 'General case' 0 N--CA 1.467 0.403 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -170.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.481 ' HA ' ' HD2' ' A' ' 20' ' ' LYS . 21.7 m-20 -62.7 -34.42 77.1 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 120.979 0.418 . . . . 0.0 111.346 -179.034 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.401 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 5.2 t70 -62.41 -41.37 98.63 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.865 178.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.447 HG23 HD22 ' A' ' 8' ' ' LEU . 1.9 mp -62.61 -39.19 83.68 Favored 'Isoleucine or valine' 0 C--O 1.233 0.206 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.6 175.574 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.481 ' HD2' ' HA ' ' A' ' 17' ' ' ASP . 90.9 mttt -58.24 -41.29 83.85 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.023 -0.535 . . . . 0.0 110.251 177.585 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 4.6 tptm -68.88 -36.01 77.57 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.099 -0.5 . . . . 0.0 110.509 -178.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.418 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -64.34 -35.96 82.57 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-O 121.23 0.538 . . . . 0.0 110.075 176.94 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.698 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.8 OUTLIER -65.67 -43.6 88.84 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.835 174.56 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 mtp85 -68.22 -38.51 81.96 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.539 -0.3 . . . . 0.0 111.764 -177.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.418 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 4.0 ptm180 -69.37 -36.7 77.09 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.902 0.382 . . . . 0.0 110.488 179.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.526 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 21.2 ttmm -70.92 -42.48 69.86 Favored 'General case' 0 N--CA 1.445 -0.676 0 CA-C-O 121.163 0.506 . . . . 0.0 109.769 177.387 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.38 -45.82 84.05 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.285 -0.87 . . . . 0.0 110.946 176.326 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.3 tp -61.71 -37.32 83.72 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.013 -0.539 . . . . 0.0 110.936 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 24.7 tp60 -65.63 -31.19 72.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.867 -0.606 . . . . 0.0 111.337 -179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.555 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 98.6 m95 -105.4 13.37 30.37 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.069 0.461 . . . . 0.0 111.462 -178.234 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 15.3 m170 -82.04 147.75 58.58 Favored Pre-proline 0 C--N 1.322 -0.618 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 170.54 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.56 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 12.2 Cg_endo -54.25 -29.4 56.97 Favored 'Trans proline' 0 N--CA 1.477 0.501 0 C-N-CA 124.27 3.313 . . . . 0.0 113.625 -167.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t70 -64.2 -30.59 71.64 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.105 178.016 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -111.56 7.55 20.64 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 121.096 0.474 . . . . 0.0 110.696 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.56 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 27.0 t-20 -107.98 140.06 21.28 Favored Pre-proline 0 C--N 1.322 -0.62 0 CA-C-N 115.987 -0.551 . . . . 0.0 110.467 -176.811 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.413 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 91.4 Cg_endo -78.02 -117.76 0.01 OUTLIER 'Trans proline' 0 CA--C 1.533 0.473 0 C-N-CA 122.863 2.375 . . . . 0.0 112.753 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.413 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 2.5 m-20 -97.11 -7.03 33.65 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 111.767 0.284 . . . . 0.0 111.767 -174.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.591 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 16.8 m120 -103.59 99.02 8.82 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 120.621 -0.431 . . . . 0.0 111.206 -173.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -93.06 -25.77 17.78 Favored 'General case' 0 C--N 1.323 -0.572 0 CA-C-N 116.065 -0.516 . . . . 0.0 109.867 177.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.413 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 7.8 tm-20 -60.85 -44.08 97.48 Favored 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.315 -0.857 . . . . 0.0 109.666 179.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.591 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 54.7 m-85 -71.97 -37.83 69.84 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.804 -0.635 . . . . 0.0 111.131 175.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.87 -46.21 88.95 Favored 'General case' 0 C--N 1.331 -0.218 0 CA-C-O 120.641 0.258 . . . . 0.0 111.184 -177.497 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -69.32 -35.63 76.13 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.413 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 5.1 tttp -58.77 -48.43 81.27 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.629 177.072 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.434 ' O ' HG12 ' A' ' 49' ' ' VAL . 63.7 mmtt -72.01 -34.99 69.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 116.18 -0.464 . . . . 0.0 110.911 -178.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 86.7 t80 -60.98 -40.19 92.5 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.243 0.544 . . . . 0.0 109.689 174.325 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 tttp -67.37 -45.87 75.0 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.761 -0.654 . . . . 0.0 110.467 177.25 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -64.79 -43.3 93.67 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.635 -178.038 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.698 HG22 ' HD1' ' A' ' 23' ' ' TYR . 12.0 p -67.89 -37.4 78.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 C-N-CA 120.709 -0.396 . . . . 0.0 110.909 -179.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.9 -45.73 92.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.775 0.322 . . . . 0.0 111.263 -178.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.08 -36.85 69.64 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.078 0.466 . . . . 0.0 110.525 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.851 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.62 -38.53 58.92 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.413 -0.812 . . . . 0.0 112.091 -173.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -70.98 -36.08 72.37 Favored 'General case' 0 C--N 1.326 -0.443 0 N-CA-C 109.06 -0.718 . . . . 0.0 109.06 177.209 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 14.3 tp10 -65.03 -47.08 78.68 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.612 -179.767 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.616 ' HA ' ' CB ' ' A' ' 61' ' ' LYS . 11.8 p -64.68 -38.71 83.37 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.206 0 CA-C-O 120.878 0.37 . . . . 0.0 111.145 -179.432 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.808 HD11 ' HB3' ' A' ' 12' ' ' ARG . 48.1 tp -74.08 -29.15 61.72 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 -179.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 27.7 t -84.19 -19.55 33.85 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-O 120.495 0.188 . . . . 0.0 111.205 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.598 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 23.3 t70 -112.36 129.99 56.11 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.383 0.611 . . . . 0.0 111.56 -174.606 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.723 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -66.69 -36.06 81.61 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 115.242 -0.89 . . . . 0.0 111.153 -175.425 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.416 ' O ' HD13 ' A' ' 64' ' ' ILE . 35.5 m170 -69.75 -41.89 74.62 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-O 121.128 0.49 . . . . 0.0 110.227 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.809 ' HA ' ' HE2' ' A' ' 61' ' ' LYS . 10.5 mmpt? -61.15 -37.76 84.04 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 116.131 -0.486 . . . . 0.0 110.603 176.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.598 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 89.0 mtt180 -61.77 -47.22 86.17 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.758 0.313 . . . . 0.0 111.427 -179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -71.39 -35.8 71.17 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.335 -0.393 . . . . 0.0 110.611 -178.15 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.6 mp -65.11 -39.19 84.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.971 -0.381 . . . . 0.0 109.971 175.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 91.2 t80 -60.62 -38.02 83.35 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.941 0.401 . . . . 0.0 110.629 177.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -73.08 -47.72 42.11 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.453 179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.407 ' HG2' ' HA ' ' A' ' 64' ' ' ILE . 8.6 ptm180 -77.01 -30.93 56.06 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.104 0.409 . . . . 0.0 112.104 -173.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -94.85 -10.14 32.22 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-O 121.286 0.565 . . . . 0.0 110.053 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.64 -47.27 10.25 Favored Glycine 0 N--CA 1.447 -0.609 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.312 179.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 28.4 mmt180 -62.82 -27.64 69.46 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-N 115.003 -0.598 . . . . 0.0 111.832 179.315 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 . . . . . 0 C--O 1.25 1.083 0 CA-C-O 118.464 -0.779 . . . . 0.0 111.376 -176.526 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 23.9 ptp . . . . . 0 N--CA 1.477 0.923 0 CA-C-O 120.875 0.369 . . . . 0.0 110.173 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -166.17 138.24 3.82 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-O 121.173 0.511 . . . . 0.0 111.472 -177.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 6.9 p -72.0 -28.64 63.53 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.191 173.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.518 ' O ' HG13 ' A' ' 7' ' ' ILE . 57.2 m-85 -67.81 -26.95 66.33 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.794 176.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 62.9 t80 -67.38 -32.7 73.79 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.538 -0.755 . . . . 0.0 109.427 176.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.9 mm-40 -73.36 -44.03 59.5 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.07 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.518 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.5 pp -70.22 -40.54 78.18 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.157 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.38 -176.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.453 HD23 HG22 ' A' ' 10' ' ' VAL . 20.2 tp -102.29 -93.08 0.31 Allowed 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 110.151 -0.314 . . . . 0.0 110.151 177.049 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.412 ' H ' ' H ' ' A' ' 10' ' ' VAL . 4.5 p30 174.27 3.85 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.468 0 O-C-N 124.021 0.826 . . . . 0.0 110.771 173.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.453 HG22 HD23 ' A' ' 8' ' ' LEU . 17.0 m -121.11 154.39 58.26 Favored Pre-proline 0 C--O 1.233 0.204 0 CA-C-O 120.643 0.258 . . . . 0.0 110.985 176.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 46.7 Cg_endo -68.41 161.7 43.74 Favored 'Trans proline' 0 C--N 1.346 0.408 0 C-N-CA 123.181 2.587 . . . . 0.0 112.619 179.708 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.534 ' HD3' ' N ' ' A' ' 13' ' ' SER . 0.0 OUTLIER -68.6 -20.4 64.5 Favored 'General case' 0 N--CA 1.463 0.218 0 CA-C-N 115.488 -0.778 . . . . 0.0 112.501 -175.083 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.534 ' N ' ' HD3' ' A' ' 12' ' ' ARG . 21.0 m -77.32 -2.51 35.28 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.154 -0.476 . . . . 0.0 111.328 -179.738 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.725 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -74.22 143.49 45.11 Favored 'General case' 0 N--CA 1.44 -0.971 0 CA-C-N 116.055 -0.52 . . . . 0.0 110.338 178.495 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.3 t -86.04 173.01 10.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.084 -0.507 . . . . 0.0 109.993 179.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.23 -39.7 60.61 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 111.798 0.296 . . . . 0.0 111.798 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -64.84 -41.16 95.94 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.448 -0.342 . . . . 0.0 111.338 178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.725 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 3.3 m-20 -62.01 -44.12 97.39 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.193 -0.458 . . . . 0.0 110.248 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.639 HG22 ' HD2' ' A' ' 53' ' ' TYR . 1.9 mp -63.92 -38.67 82.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.256 0 CA-C-N 115.963 -0.562 . . . . 0.0 110.456 176.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -36.08 80.82 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.071 -0.513 . . . . 0.0 109.798 177.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.733 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.1 mmpt? -64.07 -46.62 83.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 115.866 -0.607 . . . . 0.0 111.122 175.65 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.405 ' HB2' HG13 ' A' ' 10' ' ' VAL . . . -63.74 -37.51 87.62 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.257 0.551 . . . . 0.0 110.591 179.234 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.621 ' HA ' HG21 ' A' ' 49' ' ' VAL . 2.7 t80 -63.02 -46.7 86.39 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.792 175.155 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -67.55 -37.2 82.33 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.1 0.408 . . . . 0.0 112.1 -176.409 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.406 HH11 ' HD2' ' A' ' 25' ' ' ARG . 5.4 ptp180 -67.89 -40.76 83.48 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 120.473 -0.491 . . . . 0.0 110.177 179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.937 ' HD2' ' HB ' ' A' ' 49' ' ' VAL . 22.6 ttmm -70.23 -42.5 72.18 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-O 121.371 0.605 . . . . 0.0 109.56 179.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.55 -44.7 85.42 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.035 -0.984 . . . . 0.0 111.399 176.044 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -61.5 -46.25 90.79 Favored 'General case' 0 CA--C 1.52 -0.176 0 CA-C-N 116.36 -0.382 . . . . 0.0 111.391 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -63.09 -31.54 72.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.139 -177.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.716 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 89.1 m95 -106.09 18.89 21.37 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.077 0.465 . . . . 0.0 111.323 -178.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 m170 -83.65 143.75 44.46 Favored Pre-proline 0 C--N 1.32 -0.675 0 O-C-N 122.069 -0.395 . . . . 0.0 110.165 173.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_endo -56.0 -25.92 56.29 Favored 'Trans proline' 0 C--N 1.347 0.449 0 C-N-CA 123.671 2.914 . . . . 0.0 111.941 178.274 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -59.73 -33.63 71.89 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.294 -0.866 . . . . 0.0 111.21 174.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 73.8 mmtt -113.68 -29.88 6.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.204 -0.453 . . . . 0.0 111.633 -174.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.675 HD22 ' HB2' ' A' ' 42' ' ' ALA . 65.7 t30 -102.44 132.5 21.32 Favored Pre-proline 0 C--N 1.323 -0.585 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.62 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 74.2 Cg_endo -73.61 -115.84 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.55 0 C-N-CA 122.982 2.454 . . . . 0.0 115.699 -167.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.44 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 6.7 m-20 -85.91 -7.2 58.85 Favored 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 112.736 0.643 . . . . 0.0 112.736 -165.287 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 33.5 m-80 -101.62 98.41 8.71 Favored 'General case' 0 C--N 1.317 -0.826 0 C-N-CA 120.148 -0.621 . . . . 0.0 109.38 174.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.2 mttp -103.92 -23.13 13.39 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.767 -176.421 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.546 ' HA ' ' HG2' ' A' ' 43' ' ' GLU . 21.5 tt0 -66.26 -41.02 90.52 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.299 0.571 . . . . 0.0 110.601 -178.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 96.4 m-85 -67.34 -37.46 83.31 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 115.945 -0.57 . . . . 0.0 109.83 177.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.716 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.66 -44.39 81.99 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.25 -0.886 . . . . 0.0 111.029 178.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.546 ' HG2' ' HA ' ' A' ' 40' ' ' GLU . 12.9 pt-20 -67.34 -36.46 81.49 Favored 'General case' 0 C--N 1.328 -0.343 0 C-N-CA 121.067 -0.253 . . . . 0.0 110.75 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 47.6 mttp -60.05 -40.85 90.86 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-O 120.715 0.293 . . . . 0.0 110.706 174.331 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 68.2 mmtt -71.84 -35.25 69.82 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 120.799 0.333 . . . . 0.0 110.565 177.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.44 -39.33 92.98 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.718 174.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 62.2 tttm -65.31 -41.72 93.77 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.431 174.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -63.28 -43.2 98.6 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.473 -178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.937 ' HB ' ' HD2' ' A' ' 26' ' ' LYS . 6.7 p -70.42 -38.84 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.524 178.132 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.428 ' HA ' ' HD1' ' A' ' 53' ' ' TYR . . . -61.43 -45.07 95.85 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.554 0.216 . . . . 0.0 111.58 -178.881 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.46 ' O ' HG23 ' A' ' 55' ' ' VAL . 15.0 pt-20 -71.91 -43.63 65.03 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 121.017 0.437 . . . . 0.0 111.032 -178.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -72.12 -40.63 67.97 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.928 -0.578 . . . . 0.0 111.43 -174.629 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.639 ' HD2' HG22 ' A' ' 19' ' ' ILE . 0.1 OUTLIER -70.63 -33.66 71.23 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 109.831 -0.433 . . . . 0.0 109.831 179.16 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -60.68 -42.31 96.84 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 116.16 -0.473 . . . . 0.0 110.535 177.284 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.775 HG13 ' HG3' ' A' ' 61' ' ' LYS . 64.3 t -69.04 -44.81 80.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-O 121.001 0.429 . . . . 0.0 110.566 177.276 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.561 ' HG ' HG12 ' A' ' 19' ' ' ILE . 40.3 tp -72.25 -17.48 61.89 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.994 -0.548 . . . . 0.0 112.323 -175.664 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 69.8 m -82.83 -18.39 40.61 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 122.043 -0.41 . . . . 0.0 111.922 179.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -109.01 123.4 49.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-O 121.202 0.525 . . . . 0.0 111.482 -175.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.526 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.1 OUTLIER -61.08 -38.01 84.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.363 -0.835 . . . . 0.0 112.653 -177.734 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.421 ' O ' HD13 ' A' ' 64' ' ' ILE . 80.6 t60 -65.12 -40.51 94.56 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.06 177.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.775 ' HG3' HG13 ' A' ' 55' ' ' VAL . 0.0 OUTLIER -70.28 -33.63 71.8 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.382 177.698 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 98.2 mtt180 -62.74 -47.46 83.44 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-N 116.515 -0.311 . . . . 0.0 111.097 176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -71.32 -34.96 71.05 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.863 -177.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.421 HD13 ' O ' ' A' ' 60' ' ' HIS . 1.5 mp -65.04 -42.5 94.78 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.224 0 N-CA-C 109.94 -0.393 . . . . 0.0 109.94 174.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 88.6 t80 -65.62 -36.73 84.56 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 120.978 0.418 . . . . 0.0 110.225 177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -64.19 -47.84 78.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.82 -0.627 . . . . 0.0 111.661 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.686 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 10.8 ptm180 -88.58 -48.86 7.26 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 113.01 0.744 . . . . 0.0 113.01 -179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -94.3 -10.56 32.4 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 120.92 0.391 . . . . 0.0 111.176 -168.426 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.4 -49.32 6.29 Favored Glycine 0 N--CA 1.447 -0.608 0 C-N-CA 120.536 -0.84 . . . . 0.0 111.474 177.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -67.42 -25.52 65.97 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 114.673 -0.763 . . . . 0.0 112.751 -179.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.686 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 75.4 mm-40 . . . . . 0 C--O 1.249 1.052 0 CA-C-O 118.701 -0.666 . . . . 0.0 110.929 178.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.97 145.04 2.84 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.873 0.368 . . . . 0.0 110.795 178.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.0 m -81.25 -12.92 58.98 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.15 -0.685 . . . . 0.0 109.15 175.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.807 ' HA ' HG12 ' A' ' 7' ' ' ILE . 66.8 m-85 -68.44 -26.12 65.36 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-N 115.726 -0.67 . . . . 0.0 109.67 175.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -59.0 -39.31 81.46 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 114.936 -1.029 . . . . 0.0 109.667 176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 63.3 mm-40 -73.51 -44.21 58.29 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.818 -0.628 . . . . 0.0 111.847 179.713 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.831 HD12 ' HB1' ' A' ' 52' ' ' ALA . 12.4 pt -71.81 -42.31 69.95 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 N-CA-C 111.737 0.273 . . . . 0.0 111.737 -172.488 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.511 ' N ' HG13 ' A' ' 7' ' ' ILE . 15.6 mt -103.85 -75.3 0.62 Allowed 'General case' 0 CA--C 1.512 -0.488 0 CA-C-O 120.966 0.412 . . . . 0.0 109.937 176.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 31.9 t70 168.95 -30.56 0.0 OUTLIER 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 114.333 -1.303 . . . . 0.0 109.514 -174.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 31.0 m -120.66 154.12 56.98 Favored Pre-proline 0 C--N 1.327 -0.411 0 CA-C-N 115.134 -0.939 . . . . 0.0 110.9 -176.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 93.3 Cg_endo -80.76 -178.63 4.54 Favored 'Trans proline' 0 C--N 1.343 0.277 0 C-N-CA 122.994 2.463 . . . . 0.0 112.616 179.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.6 ptt180 -73.85 -17.58 61.04 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 120.99 0.424 . . . . 0.0 111.346 -176.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 8.2 t -65.79 -23.42 66.7 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.562 175.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.81 145.84 44.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.082 -0.508 . . . . 0.0 109.914 177.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.2 m -67.63 159.78 29.25 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 116.556 -0.293 . . . . 0.0 110.978 -175.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.04 -36.27 60.4 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.179 0.514 . . . . 0.0 111.223 -179.324 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -61.5 -40.28 94.01 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.812 178.1 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -62.2 -44.61 96.2 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.657 177.374 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.8 mp -60.85 -45.73 97.55 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.448 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.748 178.108 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 25.5 ttmm -60.83 -40.85 94.33 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.449 -0.342 . . . . 0.0 110.773 176.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.473 ' HD2' ' HA ' ' A' ' 21' ' ' LYS . 9.6 mmmm -70.33 -35.56 73.69 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 111.663 0.246 . . . . 0.0 111.663 178.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.92 -41.58 96.44 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.268 0.556 . . . . 0.0 109.642 173.375 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.54 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -65.47 -44.11 88.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.165 -0.925 . . . . 0.0 111.012 175.777 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 1.3 mtt180 -61.88 -41.16 97.53 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-O 120.748 0.309 . . . . 0.0 111.629 178.194 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 46.4 ttt180 -67.48 -44.12 79.31 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.155 0.503 . . . . 0.0 110.952 175.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.528 ' CG ' ' HB ' ' A' ' 49' ' ' VAL . 3.6 tppp? -60.35 -38.59 84.29 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.889 -0.596 . . . . 0.0 110.311 176.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.707 ' HA ' ' NE1' ' A' ' 30' ' ' TRP . . . -60.62 -42.13 96.23 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.995 175.192 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 1.5 tp -59.4 -35.4 73.89 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.65 178.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.401 ' HB2' ' O ' ' A' ' 26' ' ' LYS . 24.2 mm-40 -60.38 -33.37 72.37 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 115.707 -0.679 . . . . 0.0 112.275 -177.101 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.707 ' NE1' ' HA ' ' A' ' 27' ' ' ALA . 64.1 p-90 -106.46 6.42 30.24 Favored 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.632 -0.427 . . . . 0.0 111.626 -179.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 14.1 m170 -74.2 146.99 85.21 Favored Pre-proline 0 C--N 1.326 -0.428 0 N-CA-C 109.845 -0.428 . . . . 0.0 109.845 175.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.563 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 17.0 Cg_endo -55.67 -28.1 64.3 Favored 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 123.758 2.972 . . . . 0.0 112.687 -176.885 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -69.82 -24.38 63.46 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.256 -0.884 . . . . 0.0 111.124 179.664 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -119.16 -10.87 9.69 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.803 0.668 . . . . 0.0 112.803 -178.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.563 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.3 OUTLIER -104.44 133.86 19.98 Favored Pre-proline 0 C--N 1.329 -0.284 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 176.708 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 92.1 Cg_endo -96.56 -112.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.708 0 C-N-CA 123.394 2.73 . . . . 0.0 113.096 -177.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 16.9 t70 -85.23 -6.75 59.25 Favored 'General case' 0 N--CA 1.462 0.148 0 CA-C-O 121.61 0.719 . . . . 0.0 110.065 -178.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.769 ' HB3' ' HD2' ' A' ' 41' ' ' PHE . 14.2 m120 -90.66 103.09 15.83 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.613 -0.722 . . . . 0.0 109.731 -174.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 mmtp -98.2 -29.32 13.27 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.616 -0.72 . . . . 0.0 110.091 -177.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.513 ' O ' ' HG3' ' A' ' 44' ' ' LYS . 34.1 tt0 -59.71 -44.69 93.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.133 177.779 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.769 ' HD2' ' HB3' ' A' ' 38' ' ' ASN . 93.4 m-85 -65.04 -37.65 88.29 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.77 -0.65 . . . . 0.0 110.913 179.658 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -63.25 -44.7 94.45 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.188 -179.342 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -70.04 -37.95 75.72 Favored 'General case' 0 C--N 1.328 -0.327 0 C-N-CA 120.633 -0.427 . . . . 0.0 110.748 179.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.513 ' HG3' ' O ' ' A' ' 40' ' ' GLU . 55.7 mtpt -63.75 -46.29 85.99 Favored 'General case' 0 C--N 1.333 -0.126 0 CA-C-O 120.616 0.246 . . . . 0.0 110.99 177.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.617 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 30.1 mmtp -66.55 -34.68 78.44 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 109.983 -0.377 . . . . 0.0 109.983 179.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -60.32 -50.89 71.83 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.077 176.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.461 ' HB2' ' NZ ' ' A' ' 47' ' ' LYS . 0.0 OUTLIER -69.08 -43.15 75.14 Favored 'General case' 0 N--CA 1.455 -0.218 0 C-N-CA 120.548 -0.461 . . . . 0.0 111.103 -177.171 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.617 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 9.1 pt-20 -64.83 -37.31 87.19 Favored 'General case' 0 C--O 1.225 -0.195 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.971 -175.291 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.54 HG22 ' HD1' ' A' ' 23' ' ' TYR . 13.1 p -72.42 -38.94 61.98 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.218 0 C-N-CA 120.139 -0.625 . . . . 0.0 110.869 178.665 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.33 -45.41 91.43 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.104 -177.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.451 ' HG2' ' O ' ' A' ' 47' ' ' LYS . 11.1 pt-20 -72.02 -43.16 65.46 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-N 116.202 -0.454 . . . . 0.0 111.058 -179.17 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.831 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -75.07 -42.48 56.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.958 -0.565 . . . . 0.0 112.177 -173.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 4.1 t80 -70.89 -35.57 72.39 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 120.794 -0.363 . . . . 0.0 110.215 179.014 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 43.3 tt0 -63.96 -50.46 68.54 Favored 'General case' 0 C--N 1.33 -0.253 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.01 177.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.543 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.6 p -62.55 -41.3 91.52 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.209 0 N-CA-C 111.572 0.212 . . . . 0.0 111.572 -175.668 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.3 tp -75.18 -28.96 60.24 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 112.149 0.426 . . . . 0.0 112.149 -178.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.1 m -85.9 -19.44 30.53 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.777 0.322 . . . . 0.0 111.043 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 12.9 t0 -102.51 124.22 47.68 Favored 'General case' 0 CA--C 1.514 -0.405 0 CA-C-O 121.593 0.711 . . . . 0.0 110.767 -177.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.677 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 8.0 mptt -68.86 -31.43 70.37 Favored 'General case' 0 C--N 1.318 -0.775 0 CA-C-N 114.679 -1.146 . . . . 0.0 109.154 -175.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.61 ' HA ' ' OE1' ' A' ' 63' ' ' GLU . 87.9 m-70 -70.44 -43.83 69.06 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-N 114.738 -1.119 . . . . 0.0 111.187 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.543 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.2 OUTLIER -65.08 -34.42 78.38 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 109.6 -0.519 . . . . 0.0 109.6 175.127 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.423 HH11 ' HD2' ' A' ' 62' ' ' ARG . 13.3 mmm180 -59.25 -41.66 89.27 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.625 173.208 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.61 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 41.7 mt-10 -60.59 -43.37 97.47 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-O 120.827 0.346 . . . . 0.0 110.799 178.574 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.7 mp -67.36 -44.93 86.82 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 116.205 -0.452 . . . . 0.0 110.809 -179.812 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -66.18 -35.25 79.97 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.234 0.54 . . . . 0.0 110.413 179.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -63.89 -45.79 87.78 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.487 -0.778 . . . . 0.0 111.611 -177.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 22.5 ptt180 -88.46 -37.56 15.71 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.532 0.567 . . . . 0.0 112.532 -175.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 6.9 t80 -101.0 9.87 41.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.042 0.449 . . . . 0.0 111.495 -171.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -76.77 -56.43 4.15 Favored Glycine 0 CA--C 1.508 -0.369 0 C-N-CA 120.645 -0.788 . . . . 0.0 111.53 175.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.4 mmm180 -66.62 -36.63 83.06 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.154 -0.523 . . . . 0.0 112.064 178.06 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 . . . . . 0 C--O 1.247 0.936 0 CA-C-O 118.793 -0.623 . . . . 0.0 111.012 -176.734 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.8 ptt? . . . . . 0 N--CA 1.484 1.253 0 CA-C-O 120.664 0.269 . . . . 0.0 110.287 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -142.18 -48.09 0.36 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.792 0.33 . . . . 0.0 111.079 179.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 85.3 p 58.61 0.69 0.15 Allowed 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 124.487 1.115 . . . . 0.0 113.822 175.747 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.498 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 38.2 m-85 -68.82 -27.05 65.5 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 121.176 0.513 . . . . 0.0 110.971 -177.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.563 ' HB3' ' HA ' ' A' ' 11' ' ' PRO . 1.3 p90 -66.78 -32.7 74.16 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.846 -0.616 . . . . 0.0 110.489 173.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.404 ' HG3' ' CD1' ' A' ' 5' ' ' TYR . 37.4 mt-10 -74.25 -43.83 55.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.124 177.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.498 ' CG1' ' HA ' ' A' ' 4' ' ' TYR . 2.5 pp -71.6 -33.21 48.36 Favored 'Isoleucine or valine' 0 C--O 1.233 0.196 0 CA-C-N 116.205 -0.452 . . . . 0.0 111.781 -177.541 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.448 HD21 HG23 ' A' ' 19' ' ' ILE . 54.0 tp -99.36 -79.69 0.48 Allowed 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 121.142 -0.223 . . . . 0.0 110.966 -178.045 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 t70 176.35 -41.02 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.286 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.16 -175.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 29.7 m -122.99 151.55 61.52 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 115.539 -0.755 . . . . 0.0 111.197 -175.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.563 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 27.4 Cg_endo -64.37 151.39 85.69 Favored 'Trans proline' 0 C--N 1.346 0.403 0 C-N-CA 123.137 2.558 . . . . 0.0 112.166 177.661 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -73.38 -15.03 61.38 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.21 -172.014 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 70.9 m -62.2 -18.88 62.32 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 116.046 -0.525 . . . . 0.0 110.937 174.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.501 ' HB1' ' HB2' ' A' ' 18' ' ' ASP . . . -73.49 145.94 45.28 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 109.497 -0.556 . . . . 0.0 109.497 173.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 25.8 t -66.12 161.7 21.27 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.458 -177.002 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.58 -34.5 50.83 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.202 0.525 . . . . 0.0 110.665 179.326 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -60.72 -41.89 96.19 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.411 178.201 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.501 ' HB2' ' HB1' ' A' ' 14' ' ' ALA . 10.5 m-20 -68.28 -41.24 81.28 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.497 -178.154 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.616 HG22 ' HD1' ' A' ' 53' ' ' TYR . 1.7 mp -60.77 -42.85 93.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.932 174.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 45.7 tttp -62.0 -40.86 97.1 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.409 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.675 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 6.5 mmpt? -63.08 -40.97 99.24 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.951 -0.568 . . . . 0.0 111.4 176.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.465 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -60.45 -46.13 91.16 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.096 0.474 . . . . 0.0 110.258 177.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.476 ' HA ' HG21 ' A' ' 49' ' ' VAL . 4.1 t80 -61.94 -48.59 79.72 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.576 -0.738 . . . . 0.0 110.8 176.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -58.51 -38.95 78.76 Favored 'General case' 0 N--CA 1.446 -0.638 0 N-CA-C 112.201 0.445 . . . . 0.0 112.201 178.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.461 HH11 ' HD3' ' A' ' 25' ' ' ARG . 18.6 ttt-85 -60.58 -44.06 96.64 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.515 -0.312 . . . . 0.0 110.997 177.676 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.65 ' HD2' HG21 ' A' ' 49' ' ' VAL . 58.4 mttm -67.72 -37.19 81.9 Favored 'General case' 0 CA--C 1.512 -0.495 0 CA-C-O 121.267 0.556 . . . . 0.0 109.922 177.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.31 -47.48 75.55 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 115.039 -0.982 . . . . 0.0 110.708 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 3.5 mm? -71.89 -35.78 69.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.01 0.433 . . . . 0.0 111.047 176.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -62.01 -38.78 89.94 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.847 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 4.2 m-90 -109.61 20.69 17.86 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.915 -0.584 . . . . 0.0 111.348 178.231 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.48 ' HB2' ' HA ' ' A' ' 28' ' ' LEU . 0.4 OUTLIER -69.29 145.69 96.07 Favored Pre-proline 0 C--N 1.327 -0.384 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.382 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.422 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 10.5 Cg_endo -53.52 -34.34 72.0 Favored 'Trans proline' 0 N--CA 1.475 0.388 0 C-N-CA 122.355 2.037 . . . . 0.0 113.098 -168.528 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -69.91 -24.17 63.34 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-O 121.072 0.463 . . . . 0.0 110.969 179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.7 mmtm -113.87 7.89 17.13 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 -173.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -102.99 145.77 31.19 Favored Pre-proline 0 C--O 1.234 0.286 0 C-N-CA 120.02 -0.672 . . . . 0.0 110.058 179.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.439 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 84.0 Cg_endo -81.44 -120.39 0.01 OUTLIER 'Trans proline' 0 CA--C 1.532 0.412 0 C-N-CA 122.941 2.428 . . . . 0.0 112.949 -174.012 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.439 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 5.2 m-20 -97.11 -8.15 30.91 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-O 120.866 0.365 . . . . 0.0 111.218 -176.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -98.61 100.63 11.89 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 120.951 0.405 . . . . 0.0 110.26 177.155 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 13.8 mptt -92.61 -30.67 15.5 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.78 -0.645 . . . . 0.0 109.314 175.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 15.5 tp10 -60.84 -43.94 97.62 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.12 -0.945 . . . . 0.0 109.897 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 87.7 m-85 -72.32 -38.29 68.71 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 115.342 -0.844 . . . . 0.0 111.586 -179.7 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -61.27 -46.32 90.83 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 120.705 0.288 . . . . 0.0 110.798 -179.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.523 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 11.2 pt-20 -71.22 -37.76 72.04 Favored 'General case' 0 C--N 1.327 -0.371 0 C-N-CA 120.835 -0.346 . . . . 0.0 110.907 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.419 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 20.6 tptp -61.12 -45.96 92.53 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 120.762 0.315 . . . . 0.0 110.549 179.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' O ' HG12 ' A' ' 49' ' ' VAL . 31.9 mmtp -65.96 -38.14 87.82 Favored 'General case' 0 CA--C 1.519 -0.219 0 CA-C-N 116.131 -0.486 . . . . 0.0 109.995 178.652 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.0 t80 -62.15 -40.08 94.77 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.237 -0.892 . . . . 0.0 110.653 178.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.436 ' HG2' ' O ' ' A' ' 43' ' ' GLU . 74.4 mmtt -66.74 -41.77 87.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.435 -0.348 . . . . 0.0 110.856 179.262 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 51.1 mt-10 -64.32 -44.12 92.54 Favored 'General case' 0 C--N 1.331 -0.215 0 CA-C-N 116.407 -0.36 . . . . 0.0 111.001 -177.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.65 HG21 ' HD2' ' A' ' 26' ' ' LYS . 7.3 p -72.03 -38.28 63.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 C-N-CA 120.626 -0.429 . . . . 0.0 111.007 179.495 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.71 -45.08 95.6 Favored 'General case' 0 C--N 1.329 -0.29 0 C-N-CA 121.213 -0.195 . . . . 0.0 111.37 -178.725 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 10.7 pt-20 -72.05 -40.27 68.46 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.944 0.402 . . . . 0.0 110.728 -179.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.402 ' N ' ' HG3' ' A' ' 51' ' ' GLU . . . -72.39 -38.96 68.32 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.81 -0.632 . . . . 0.0 111.633 -174.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 19' ' ' ILE . 0.0 OUTLIER -70.84 -40.48 72.35 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.675 -0.491 . . . . 0.0 109.675 177.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -62.12 -49.88 74.14 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.012 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 12.7 p -66.02 -38.08 81.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.266 0 CA-C-O 120.745 0.307 . . . . 0.0 111.306 -177.49 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 57.0 tp -72.99 -26.26 61.28 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.772 0.32 . . . . 0.0 111.418 179.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 73.0 m -82.06 -18.8 41.86 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.674 -179.092 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.483 ' HB3' ' HB2' ' A' ' 61' ' ' LYS . 17.6 t70 -110.35 122.2 47.12 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.049 0.452 . . . . 0.0 110.318 -176.281 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.532 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -66.35 -34.33 77.73 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.788 -0.642 . . . . 0.0 111.427 -174.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.532 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 33.6 t60 -71.97 -40.51 68.58 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 120.948 0.404 . . . . 0.0 110.54 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.483 ' HB2' ' HB3' ' A' ' 58' ' ' ASP . 0.0 OUTLIER -64.13 -34.32 77.8 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.052 -0.522 . . . . 0.0 109.972 177.339 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.424 ' O ' ' HB2' ' A' ' 66' ' ' ASP . 0.8 OUTLIER -60.15 -42.56 95.14 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.571 -0.74 . . . . 0.0 110.788 173.805 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.507 ' OE1' ' HA ' ' A' ' 60' ' ' HIS . 38.4 mt-10 -61.05 -44.71 96.98 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.176 0.512 . . . . 0.0 110.107 176.791 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 48.7 mm -68.82 -46.09 79.89 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.412 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.804 -175.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 55.9 t80 -64.5 -35.91 82.49 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-O 121.004 0.431 . . . . 0.0 110.562 -177.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 62' ' ' ARG . 0.7 OUTLIER -70.32 -45.66 65.78 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.088 -174.241 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.582 ' O ' ' HG2' ' A' ' 71' ' ' GLU . 9.1 ptm180 -85.61 -27.48 25.43 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.742 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.0 t80 -91.4 9.93 29.66 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-O 121.806 0.812 . . . . 0.0 109.792 -174.045 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -89.82 -50.4 3.11 Favored Glycine 0 N--CA 1.442 -0.904 0 CA-C-N 115.067 -0.97 . . . . 0.0 111.17 172.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 14.2 mmm180 -65.16 -46.92 78.88 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 114.755 -0.723 . . . . 0.0 111.812 -179.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 9.5 pt-20 . . . . . 0 C--O 1.249 1.029 0 CA-C-O 118.247 -0.882 . . . . 0.0 110.413 -179.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.481 1.099 0 CA-C-O 120.83 0.347 . . . . 0.0 110.766 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.472 ' HB1' ' HD2' ' A' ' 4' ' ' TYR . . . -171.05 -49.7 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.475 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.018 179.398 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 7.9 t 69.34 -6.56 0.94 Allowed 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 114.986 -1.006 . . . . 0.0 111.941 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.581 ' HA ' ' CG1' ' A' ' 7' ' ' ILE . 85.1 m-85 -62.54 -29.86 70.87 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-O 120.86 0.362 . . . . 0.0 111.52 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -63.78 -34.78 78.67 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.914 0.388 . . . . 0.0 110.758 176.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -75.45 -43.87 47.35 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.277 -0.42 . . . . 0.0 111.899 176.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.613 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -67.82 -38.37 80.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-O 120.882 0.372 . . . . 0.0 111.039 -177.234 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 31.1 tp -101.01 -93.97 0.28 Allowed 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 109.781 -0.451 . . . . 0.0 109.781 175.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.494 ' OD1' HG13 ' A' ' 10' ' ' VAL . 4.5 p30 -178.72 -19.87 0.0 OUTLIER 'General case' 0 C--O 1.234 0.256 0 CA-C-N 116.18 -0.463 . . . . 0.0 110.58 177.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.494 HG13 ' OD1' ' A' ' 9' ' ' ASP . 16.2 m -118.74 150.9 49.24 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 120.984 0.421 . . . . 0.0 110.768 178.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -94.85 -178.12 0.53 Allowed 'Trans proline' 0 N--CA 1.451 -1.014 0 C-N-CA 123.405 2.737 . . . . 0.0 112.982 179.792 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 32.3 ptt85 -64.66 -27.56 69.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.032 -0.531 . . . . 0.0 111.682 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.8 p -63.3 -20.49 65.52 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.705 -0.68 . . . . 0.0 112.448 -176.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -80.33 146.98 31.3 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 116.632 -0.258 . . . . 0.0 110.54 178.675 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 29.6 t -50.56 141.68 12.05 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.056 -0.52 . . . . 0.0 110.137 175.286 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -56.64 -31.92 64.84 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 121.004 0.43 . . . . 0.0 110.699 178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.489 ' O ' ' HG2' ' A' ' 21' ' ' LYS . 7.3 m-20 -65.91 -34.61 78.51 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.984 -0.553 . . . . 0.0 110.766 174.351 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.42 -43.26 77.57 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.146 -0.479 . . . . 0.0 110.222 178.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.537 HG12 ' CD1' ' A' ' 56' ' ' LEU . 2.0 mp -60.26 -38.95 79.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-O 121.35 0.595 . . . . 0.0 109.862 173.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 14.9 ttmm -65.32 -34.72 79.0 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 115.748 -0.66 . . . . 0.0 109.912 177.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.81 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -64.37 -43.23 95.14 Favored 'General case' 0 CA--C 1.518 -0.279 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 173.606 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -59.77 -44.79 93.71 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.585 -0.734 . . . . 0.0 110.105 178.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.2 OUTLIER -62.09 -42.65 99.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.11 -0.495 . . . . 0.0 111.135 176.314 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 59.8 mtp180 -66.83 -43.6 83.31 Favored 'General case' 0 C--N 1.329 -0.318 0 C-N-CA 120.496 -0.482 . . . . 0.0 111.523 -177.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 23.0 ptt180 -70.15 -32.2 70.07 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 120.332 -0.547 . . . . 0.0 110.127 177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -61.17 -43.47 98.83 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.423 0.63 . . . . 0.0 109.973 174.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.5 -47.79 71.89 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.96 177.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.405 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.7 mp -68.37 -36.53 79.32 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.097 -0.501 . . . . 0.0 111.868 -176.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 58.7 tp60 -62.17 -39.57 93.1 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.885 0.374 . . . . 0.0 111.153 -178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -108.42 18.77 20.61 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.326 0.584 . . . . 0.0 110.614 -176.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.506 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 14.2 t-80 -71.86 139.32 82.87 Favored Pre-proline 0 C--N 1.322 -0.61 0 CA-C-N 115.457 -0.792 . . . . 0.0 108.965 179.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.506 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 14.7 Cg_endo -55.97 -32.22 84.96 Favored 'Trans proline' 0 C--N 1.351 0.67 0 C-N-CA 123.912 3.075 . . . . 0.0 114.424 -170.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -70.66 -28.92 65.16 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 120.794 0.33 . . . . 0.0 110.605 178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -101.27 9.73 41.45 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.533 177.708 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.437 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.9 t-20 -104.5 134.28 19.75 Favored Pre-proline 0 C--N 1.325 -0.475 0 CA-C-N 115.953 -0.567 . . . . 0.0 109.8 -179.154 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -82.73 -110.17 0.01 OUTLIER 'Trans proline' 0 N--CA 1.459 -0.545 0 C-N-CA 122.824 2.35 . . . . 0.0 113.489 -177.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -97.67 -11.59 23.35 Favored 'General case' 0 CA--C 1.519 -0.241 0 N-CA-C 112.195 0.443 . . . . 0.0 112.195 -172.139 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 58.5 m-80 -107.89 101.29 10.58 Favored 'General case' 0 C--N 1.32 -0.688 0 C-N-CA 120.531 -0.468 . . . . 0.0 110.874 -176.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.3 mppt? -98.94 -18.98 17.56 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.17 -177.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 24.2 tp10 -59.42 -47.61 84.82 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.267 -177.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.416 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 7.9 p90 -72.06 -36.54 69.61 Favored 'General case' 0 C--N 1.318 -0.774 0 C-N-CA 120.242 -0.583 . . . . 0.0 110.238 178.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -60.2 -44.9 94.74 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-N 116.682 -0.235 . . . . 0.0 111.367 -178.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.401 ' HG3' ' HD2' ' A' ' 44' ' ' LYS . 6.7 pt-20 -68.9 -38.77 79.82 Favored 'General case' 0 C--O 1.233 0.21 0 C-N-CA 120.919 -0.312 . . . . 0.0 110.885 -178.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.401 ' HD2' ' HG3' ' A' ' 43' ' ' GLU . 12.7 mptt -68.61 -36.55 78.82 Favored 'General case' 0 C--N 1.332 -0.153 0 C-N-CA 120.71 -0.396 . . . . 0.0 111.04 176.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.496 ' HA ' ' HG2' ' A' ' 48' ' ' GLU . 66.8 mmtt -64.71 -33.34 75.74 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-O 121.009 0.433 . . . . 0.0 110.283 177.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 72.6 t80 -68.92 -39.94 79.37 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.328 175.168 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 15.8 tppt? -62.59 -47.8 82.2 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-N 116.166 -0.47 . . . . 0.0 111.108 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HG2' ' HA ' ' A' ' 45' ' ' LYS . 7.1 pt-20 -65.87 -44.08 86.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.314 -176.625 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.635 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 7.7 p -65.58 -38.34 82.13 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.173 0 C-N-CA 120.237 -0.585 . . . . 0.0 111.144 -177.477 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.47 -47.85 82.19 Favored 'General case' 0 C--N 1.325 -0.47 0 C-N-CA 120.568 -0.453 . . . . 0.0 110.903 -177.741 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -74.0 -41.31 62.08 Favored 'General case' 0 C--N 1.33 -0.261 0 C-N-CA 120.549 -0.461 . . . . 0.0 111.157 -178.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.613 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -74.44 -35.95 63.37 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.183 -0.462 . . . . 0.0 111.922 -173.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.635 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.1 OUTLIER -69.18 -42.72 75.47 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 176.638 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -57.95 -48.49 79.8 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.809 179.13 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.436 HG12 ' HA ' ' A' ' 52' ' ' ALA . 11.2 p -69.68 -41.64 80.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.598 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.731 HD22 ' HD3' ' A' ' 62' ' ' ARG . 2.9 tm? -73.91 -30.27 62.49 Favored 'General case' 0 CA--C 1.532 0.284 0 N-CA-C 111.771 0.286 . . . . 0.0 111.771 -176.642 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 32.1 t -78.96 -17.57 55.22 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 122.153 -0.342 . . . . 0.0 110.861 -176.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.491 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 22.0 t70 -112.44 127.53 56.06 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.321 0.581 . . . . 0.0 110.504 179.401 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.51 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.41 -36.36 82.64 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.835 -0.62 . . . . 0.0 112.293 -175.33 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.51 ' N ' ' HD3' ' A' ' 59' ' ' LYS . 73.6 t60 -68.37 -40.56 81.41 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 116.213 -0.449 . . . . 0.0 110.838 -178.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.491 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 74.9 mmtt -61.17 -43.18 99.28 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.322 -0.399 . . . . 0.0 110.549 179.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.731 ' HD3' HD22 ' A' ' 56' ' ' LEU . 50.6 mtm105 -60.45 -45.08 94.99 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-O 120.957 0.408 . . . . 0.0 110.775 178.301 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -60.9 -39.91 91.11 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.622 178.592 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.477 HG12 ' O ' ' A' ' 60' ' ' HIS . 33.8 mm -65.2 -44.26 95.28 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.078 178.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 79.6 t80 -61.59 -38.49 87.74 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 121.061 0.458 . . . . 0.0 110.516 179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -64.99 -46.36 81.79 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.775 -0.648 . . . . 0.0 111.421 -178.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.425 ' HD3' HD13 ' A' ' 64' ' ' ILE . 11.7 ptm180 -81.4 -28.44 34.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 113.003 0.742 . . . . 0.0 113.003 -176.714 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 55.0 t80 -93.49 -8.61 41.03 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 120.86 0.362 . . . . 0.0 110.799 -174.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -52.42 -50.53 47.24 Favored Glycine 0 N--CA 1.452 -0.286 0 CA-C-N 116.041 -0.527 . . . . 0.0 112.703 178.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 35.1 mmt180 -67.07 -28.24 68.03 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.181 -0.509 . . . . 0.0 112.111 -178.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 23.5 mm-40 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 118.523 -0.751 . . . . 0.0 111.056 -179.953 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptm . . . . . 0 N--CA 1.482 1.128 0 N-CA-C 109.969 -0.382 . . . . 0.0 109.969 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.705 ' HA ' ' HE2' ' A' ' 65' ' ' TYR . . . -110.62 -34.76 6.2 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -177.409 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 61.1 m 59.16 29.37 18.91 Favored 'General case' 0 C--O 1.226 -0.139 0 CA-C-O 121.343 0.592 . . . . 0.0 110.307 -173.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.831 ' HA ' HG12 ' A' ' 7' ' ' ILE . 0.0 OUTLIER -69.17 -38.01 78.49 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.293 -172.888 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.618 ' HA ' ' O ' ' A' ' 10' ' ' VAL . 22.6 p90 -61.28 -33.27 73.28 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.147 173.449 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.408 ' HG2' ' CE2' ' A' ' 5' ' ' TYR . 4.5 mt-10 -75.37 -44.21 46.2 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.996 -0.547 . . . . 0.0 111.626 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.831 HG12 ' HA ' ' A' ' 4' ' ' TYR . 11.0 pt -70.5 -40.33 77.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.685 0.624 . . . . 0.0 112.685 -169.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.486 HD13 HG23 ' A' ' 19' ' ' ILE . 18.5 mt -93.34 -75.61 0.49 Allowed 'General case' 0 CA--C 1.514 -0.418 0 C-N-CA 120.343 -0.543 . . . . 0.0 110.319 -176.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 29.0 t70 171.58 -24.48 0.0 OUTLIER 'General case' 0 N--CA 1.465 0.313 0 O-C-N 124.338 1.024 . . . . 0.0 110.779 -175.068 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.618 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 31.4 m -118.61 150.88 49.01 Favored Pre-proline 0 C--N 1.325 -0.472 0 CA-C-N 116.44 -0.346 . . . . 0.0 111.593 -170.147 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -91.36 -179.78 1.44 Allowed 'Trans proline' 0 N--CA 1.46 -0.458 0 C-N-CA 123.534 2.823 . . . . 0.0 113.067 -177.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.658 ' HA ' ' HE2' ' A' ' 4' ' ' TYR . 32.9 mtm180 -60.14 -15.16 21.4 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-N 114.948 -1.024 . . . . 0.0 113.459 -167.324 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.4 p -82.18 -6.82 59.48 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.048 0.388 . . . . 0.0 112.048 -178.565 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -81.06 135.39 35.82 Favored 'General case' 0 N--CA 1.446 -0.656 0 CA-C-O 121.103 0.478 . . . . 0.0 111.044 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 14.3 t -81.05 166.11 21.05 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.775 -0.648 . . . . 0.0 110.619 178.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.31 -43.75 64.68 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 -172.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.463 ' O ' ' HB3' ' A' ' 20' ' ' LYS . 1.3 m-20 -65.74 -33.45 75.9 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.835 0.35 . . . . 0.0 111.534 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -67.68 -40.49 84.41 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.486 HG23 HD13 ' A' ' 8' ' ' LEU . 1.8 mp -60.68 -41.52 88.51 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.056 173.351 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.463 ' HB3' ' O ' ' A' ' 17' ' ' ASP . 36.4 ttmt -55.74 -43.71 76.87 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.18 176.232 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 12.8 mmmm -69.37 -35.66 76.05 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 115.849 -0.614 . . . . 0.0 111.225 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.511 ' HA ' ' HG2' ' A' ' 25' ' ' ARG . . . -60.45 -42.51 96.3 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.082 0.468 . . . . 0.0 110.472 177.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.666 ' HD1' HG22 ' A' ' 49' ' ' VAL . 3.4 t80 -63.22 -43.23 98.69 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.864 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.406 ' O ' HD13 ' A' ' 28' ' ' LEU . 70.9 mtp180 -68.31 -44.17 76.0 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 112.18 0.437 . . . . 0.0 112.18 -178.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.511 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 10.1 ptm180 -66.1 -33.52 75.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.04 0.448 . . . . 0.0 110.492 -178.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.622 ' HD3' ' HB ' ' A' ' 49' ' ' VAL . 35.7 tttp -70.42 -43.59 69.66 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.689 -0.687 . . . . 0.0 109.556 176.82 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -57.48 -47.74 81.07 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.06 -0.973 . . . . 0.0 111.566 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.406 HD13 ' O ' ' A' ' 24' ' ' ARG . 7.4 mp -62.88 -37.59 87.51 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.168 -0.469 . . . . 0.0 111.336 -178.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -62.73 -30.17 71.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.103 -0.499 . . . . 0.0 110.975 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.591 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 59.1 m95 -108.46 17.56 21.94 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.165 0.507 . . . . 0.0 111.479 -178.102 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 28.7 m170 -83.19 152.32 64.7 Favored Pre-proline 0 C--N 1.323 -0.563 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 171.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 14.1 Cg_endo -54.9 -27.04 51.63 Favored 'Trans proline' 0 N--CA 1.478 0.56 0 C-N-CA 123.845 3.03 . . . . 0.0 112.862 -176.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.51 -34.79 77.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.36 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -107.14 -31.88 8.06 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.022 0.439 . . . . 0.0 111.554 -177.591 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -103.9 135.0 19.42 Favored Pre-proline 0 C--N 1.321 -0.645 0 N-CA-C 109.463 -0.569 . . . . 0.0 109.463 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.443 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 72.0 Cg_endo -71.12 -119.23 0.0 OUTLIER 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 122.82 2.347 . . . . 0.0 114.589 -169.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.443 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 34.7 t70 -94.29 -7.65 41.3 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 -167.194 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 47.3 t-20 -93.55 101.64 13.82 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 109.391 -0.596 . . . . 0.0 109.391 -179.628 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp -94.52 -26.88 16.24 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.953 -0.567 . . . . 0.0 110.878 -173.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 29.8 tt0 -59.13 -46.51 88.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.291 -0.413 . . . . 0.0 111.273 -175.227 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.466 ' O ' ' HG2' ' A' ' 45' ' ' LYS . 18.9 m-85 -72.96 -38.5 66.72 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.236 -0.438 . . . . 0.0 111.122 179.029 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.591 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -62.47 -46.15 89.8 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.195 -0.457 . . . . 0.0 111.12 -177.337 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.426 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 3.1 pt-20 -70.29 -36.04 74.09 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.568 -0.287 . . . . 0.0 110.354 178.479 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.621 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 12.1 mmmt -58.83 -44.64 90.96 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.517 -0.311 . . . . 0.0 110.875 177.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.466 ' HG2' ' O ' ' A' ' 41' ' ' PHE . 30.6 mmtp -66.84 -35.35 79.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 121.123 0.487 . . . . 0.0 110.075 179.867 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 92.6 t80 -64.16 -40.25 95.74 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.438 -0.801 . . . . 0.0 110.296 174.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -67.01 -36.52 82.32 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.301 -0.408 . . . . 0.0 110.99 176.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.621 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 43.4 mm-40 -63.29 -44.69 94.31 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-O 121.014 0.435 . . . . 0.0 110.417 -179.574 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.666 HG22 ' HD1' ' A' ' 23' ' ' TYR . 3.2 p -72.73 -37.38 55.34 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 C-N-CA 120.732 -0.387 . . . . 0.0 110.92 177.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.62 -44.94 81.67 Favored 'General case' 0 C--N 1.328 -0.358 0 C-N-CA 120.987 -0.285 . . . . 0.0 111.475 -177.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.16 -42.85 62.32 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.05 0.453 . . . . 0.0 111.244 179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.619 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -71.47 -34.84 70.56 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.392 0.615 . . . . 0.0 111.552 -176.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.421 ' CE1' ' HA ' ' A' ' 20' ' ' LYS . 28.0 t80 -71.58 -34.7 70.16 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 115.897 -0.592 . . . . 0.0 109.932 175.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -60.03 -49.99 75.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.119 177.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.836 HG23 ' HG3' ' A' ' 61' ' ' LYS . 7.1 p -65.18 -38.52 82.88 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-O 120.811 0.338 . . . . 0.0 110.737 -179.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.551 HD13 ' O ' ' A' ' 56' ' ' LEU . 0.8 OUTLIER -73.73 -18.49 60.98 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-O 120.983 0.421 . . . . 0.0 110.96 179.171 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 48.1 t -78.27 -22.81 47.75 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.01 -174.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -112.15 124.56 52.7 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 60' ' ' HIS . 0.0 OUTLIER -66.15 -35.84 81.55 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.297 0.57 . . . . 0.0 110.98 -172.86 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.622 ' O ' HG12 ' A' ' 64' ' ' ILE . 48.9 t60 -70.6 -41.4 72.36 Favored 'General case' 0 C--N 1.318 -0.765 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.126 177.541 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.836 ' HG3' HG23 ' A' ' 55' ' ' VAL . 3.7 tppp? -61.87 -36.35 81.02 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.993 -0.548 . . . . 0.0 110.523 178.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -58.86 -46.55 87.49 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.516 179.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.1 pt-20 -71.71 -33.96 69.19 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.693 0.282 . . . . 0.0 110.343 -178.017 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.622 HG12 ' O ' ' A' ' 60' ' ' HIS . 48.9 mm -64.51 -44.68 96.92 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.157 0 CA-C-O 121.129 0.49 . . . . 0.0 109.704 177.478 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.705 ' HE2' ' HA ' ' A' ' 2' ' ' ALA . 60.1 t80 -58.63 -41.99 87.25 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.874 178.295 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.7 t70 -72.85 -45.91 55.82 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.797 -175.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 15.2 ptt180 -86.72 -29.31 22.5 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.577 0.584 . . . . 0.0 112.577 -174.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 38.0 t80 -94.68 -7.23 41.33 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 121.126 0.489 . . . . 0.0 110.201 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.25 -37.45 94.55 Favored Glycine 0 N--CA 1.45 -0.367 0 N-CA-C 111.444 -0.662 . . . . 0.0 111.444 174.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 31.2 mmm180 -60.7 -26.41 67.13 Favored 'General case' 0 C--N 1.316 -0.851 0 CA-C-N 113.923 -1.138 . . . . 0.0 111.701 177.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 . . . . . 0 C--O 1.244 0.794 0 CA-C-O 118.478 -0.773 . . . . 0.0 110.764 179.462 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 120.945 0.403 . . . . 0.0 109.945 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.455 ' C ' ' H ' ' A' ' 4' ' ' TYR . . . -83.61 74.85 10.09 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 116.054 -0.521 . . . . 0.0 110.476 179.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.421 ' HA ' ' CZ ' ' A' ' 5' ' ' TYR . 3.1 m -73.72 33.02 0.08 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.065 -179.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.618 ' O ' HG13 ' A' ' 7' ' ' ILE . 60.2 m-85 -68.31 -24.58 64.86 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.33 -0.396 . . . . 0.0 110.694 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.515 ' CD1' ' HG2' ' A' ' 6' ' ' GLU . 4.3 p90 -57.63 -32.73 67.53 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.366 -0.379 . . . . 0.0 110.766 173.315 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.515 ' HG2' ' CD1' ' A' ' 5' ' ' TYR . 9.1 mm-40 -73.59 -44.32 57.49 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.021 0.438 . . . . 0.0 110.929 178.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.618 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.3 pp -71.11 -31.02 43.31 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.176 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.751 -174.972 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.418 HD21 HG23 ' A' ' 19' ' ' ILE . 61.1 tp -97.66 -79.94 0.46 Allowed 'General case' 0 N--CA 1.45 -0.43 0 CA-C-N 116.583 -0.28 . . . . 0.0 110.601 -179.153 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.637 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 25.1 t70 174.73 -40.56 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.215 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -178.084 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.422 ' O ' ' HA ' ' A' ' 5' ' ' TYR . 30.1 m -121.72 157.49 56.86 Favored Pre-proline 0 C--N 1.324 -0.522 0 CA-C-N 115.025 -0.988 . . . . 0.0 110.527 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.514 ' HA ' ' HB3' ' A' ' 5' ' ' TYR . 5.9 Cg_exo -78.34 159.82 29.35 Favored 'Trans proline' 0 C--N 1.342 0.227 0 C-N-CA 123.388 2.725 . . . . 0.0 112.486 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.8 ptt180 -62.44 -22.55 66.29 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.646 -179.619 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -65.71 -17.97 64.99 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-N 115.679 -0.691 . . . . 0.0 111.277 179.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -73.98 146.46 43.84 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.119 -0.491 . . . . 0.0 109.819 176.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.8 t -59.61 156.67 13.08 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.301 -0.409 . . . . 0.0 110.635 -178.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.07 -42.35 63.11 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 111.946 0.35 . . . . 0.0 111.946 -174.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -62.89 -34.57 77.68 Favored 'General case' 0 C--O 1.221 -0.413 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.051 179.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -61.71 -44.13 97.51 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.621 0.248 . . . . 0.0 111.112 -179.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.418 HG23 HD21 ' A' ' 8' ' ' LEU . 2.0 mp -60.2 -44.61 95.79 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-O 121.338 0.589 . . . . 0.0 109.979 175.681 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -65.43 -36.98 85.56 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.471 178.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.829 ' HA ' ' HE3' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -68.45 -40.98 80.9 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.076 176.761 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.637 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.54 -44.21 96.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.892 0.377 . . . . 0.0 110.756 179.722 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.61 ' HD1' HG22 ' A' ' 49' ' ' VAL . 1.1 t80 -57.98 -49.39 76.97 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.686 175.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.407 HH11 ' HD2' ' A' ' 24' ' ' ARG . 25.9 mtp180 -68.0 -32.68 73.24 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.706 0.288 . . . . 0.0 111.176 -178.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 22.3 ttm180 -63.75 -46.62 84.5 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 116.224 -0.444 . . . . 0.0 111.304 178.171 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 33.0 ttmt -70.96 -40.85 71.74 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.067 179.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.27 -37.2 66.96 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.422 172.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.422 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 1.0 OUTLIER -70.5 -36.86 74.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.473 178.606 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 13.1 mm-40 -63.31 -35.63 81.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.079 0.466 . . . . 0.0 110.616 178.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.437 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 29.4 m95 -105.75 19.0 21.26 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.991 -0.55 . . . . 0.0 110.651 -177.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.533 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 1.2 t-80 -72.3 141.41 83.34 Favored Pre-proline 0 C--N 1.325 -0.49 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 179.341 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.533 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 13.4 Cg_endo -55.2 -31.06 74.37 Favored 'Trans proline' 0 C--N 1.349 0.578 0 C-N-CA 123.844 3.029 . . . . 0.0 114.205 -168.036 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -70.61 -34.48 72.16 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 121.025 0.44 . . . . 0.0 111.183 177.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 5.0 tptm -90.26 -0.74 57.76 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.326 0.584 . . . . 0.0 110.08 179.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.482 ' ND2' ' HB2' ' A' ' 42' ' ' ALA . 26.8 t-20 -103.2 141.83 23.3 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.54 -176.765 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.428 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 88.4 Cg_endo -74.89 -120.93 0.01 OUTLIER 'Trans proline' 0 C--N 1.346 0.399 0 C-N-CA 122.427 2.085 . . . . 0.0 112.695 -177.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.428 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 11.9 m-20 -100.15 -8.23 23.9 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 112.278 0.473 . . . . 0.0 112.278 -176.731 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -104.9 100.94 10.55 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.972 0.415 . . . . 0.0 110.467 178.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.449 ' HD3' ' N ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -96.88 -17.87 19.88 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.268 -177.622 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.453 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 6.6 tp10 -53.4 -46.93 69.91 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 115.624 -0.716 . . . . 0.0 111.451 -178.178 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -73.47 -36.73 65.89 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 120.518 -0.473 . . . . 0.0 110.618 179.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HB2' ' ND2' ' A' ' 35' ' ' ASN . . . -62.17 -45.78 91.89 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.742 0.306 . . . . 0.0 111.231 -177.823 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.449 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 9.4 pt-20 -69.59 -37.64 77.02 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.521 -0.309 . . . . 0.0 110.496 179.072 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.644 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -60.56 -45.77 92.68 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.415 -0.357 . . . . 0.0 110.162 178.537 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -66.03 -39.28 90.06 Favored 'General case' 0 CA--C 1.519 -0.25 0 CA-C-N 116.055 -0.521 . . . . 0.0 110.281 178.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 88.2 t80 -59.04 -40.33 84.73 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.491 -0.777 . . . . 0.0 110.213 177.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -68.13 -40.97 82.33 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 116.05 -0.523 . . . . 0.0 110.716 178.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.644 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 13.4 mm-40 -63.64 -44.59 93.41 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 0.0 110.999 -176.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.61 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.3 p -72.26 -37.76 59.78 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 C-N-CA 120.917 -0.313 . . . . 0.0 110.791 179.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.88 -45.94 92.59 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 111.686 0.254 . . . . 0.0 111.686 -177.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -72.41 -38.85 68.3 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.981 0.42 . . . . 0.0 110.871 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -71.38 -36.95 71.61 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.735 -0.666 . . . . 0.0 111.666 -175.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -72.77 -36.98 67.76 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.902 -0.407 . . . . 0.0 109.902 176.08 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.4 tm-20 -60.23 -47.49 85.76 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 115.994 -0.548 . . . . 0.0 110.513 -179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.571 HG23 ' HB3' ' A' ' 61' ' ' LYS . 9.0 p -69.78 -38.12 75.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.404 0 CA-C-N 116.2 -0.454 . . . . 0.0 111.091 179.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.479 ' CD1' ' HB3' ' A' ' 4' ' ' TYR . 8.2 tt -71.59 -29.34 64.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 112.014 0.376 . . . . 0.0 112.014 -173.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 22.8 m -78.86 -19.38 52.13 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.669 0.271 . . . . 0.0 111.514 -174.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.483 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 21.7 t70 -113.13 133.38 55.06 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.292 0.568 . . . . 0.0 111.415 -176.487 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.536 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -64.96 -34.47 78.5 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.116 -0.947 . . . . 0.0 110.853 -177.769 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.448 ' O ' HG12 ' A' ' 64' ' ' ILE . 37.3 m80 -68.96 -44.43 72.97 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-O 121.176 0.512 . . . . 0.0 110.124 -177.573 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.571 ' HB3' HG23 ' A' ' 55' ' ' VAL . 14.1 mmmm -65.01 -37.94 89.28 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.654 -0.703 . . . . 0.0 111.566 -176.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.407 ' HG3' ' O ' ' A' ' 58' ' ' ASP . 27.7 mtm180 -66.16 -45.58 80.44 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 111.488 0.181 . . . . 0.0 111.488 -177.201 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.411 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 9.7 pt-20 -71.76 -32.71 67.98 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.749 -0.38 . . . . 0.0 110.893 -179.855 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.605 HD13 ' HD3' ' A' ' 67' ' ' ARG . 30.1 mm -66.84 -36.01 76.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 174.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 58.4 t80 -63.18 -36.2 82.82 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.216 -0.447 . . . . 0.0 110.44 176.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -66.19 -45.7 79.93 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.968 -0.293 . . . . 0.0 111.582 179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.605 ' HD3' HD13 ' A' ' 64' ' ' ILE . 10.2 ptm180 -83.93 -47.13 11.35 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 112.896 0.702 . . . . 0.0 112.896 -177.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 59.0 t80 -94.65 -9.61 34.41 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.91 0.386 . . . . 0.0 111.239 -172.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -79.59 -53.06 4.48 Favored Glycine 0 CA--C 1.507 -0.425 0 C-N-CA 120.72 -0.752 . . . . 0.0 111.982 178.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 23.2 mmm-85 -61.18 -27.04 68.13 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 115.05 -0.575 . . . . 0.0 112.197 -177.503 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 . . . . . 0 C--O 1.25 1.109 0 CA-C-O 118.614 -0.708 . . . . 0.0 110.609 -179.02 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.9 mtm . . . . . 0 N--CA 1.482 1.151 0 CA-C-O 121.066 0.46 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.414 ' CB ' ' HD2' ' A' ' 12' ' ' ARG . . . -157.4 103.19 1.95 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.41 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . 0.451 ' O ' HG23 ' A' ' 7' ' ' ILE . 15.8 m -81.47 31.36 0.34 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.083 0.468 . . . . 0.0 110.944 -179.013 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.696 ' OH ' HG12 ' A' ' 19' ' ' ILE . 1.0 OUTLIER -63.59 -37.37 87.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.845 -0.616 . . . . 0.0 110.087 -179.08 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 30.5 p90 -67.5 -31.92 72.38 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-O 120.918 0.389 . . . . 0.0 110.677 175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -73.23 -44.35 59.7 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.392 178.073 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.802 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.5 pp -70.43 -39.12 76.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.362 0 CA-C-N 115.943 -0.572 . . . . 0.0 111.315 -175.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.475 HD21 ' HB3' ' A' ' 22' ' ' ALA . 38.0 tp -101.47 -82.27 0.47 Allowed 'General case' 0 N--CA 1.449 -0.517 0 CA-C-N 116.262 -0.426 . . . . 0.0 111.12 -177.565 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.9 t70 174.08 -29.63 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.029 -175.747 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.2 m -119.56 155.44 54.35 Favored Pre-proline 0 C--N 1.325 -0.489 0 CA-C-N 115.768 -0.651 . . . . 0.0 111.098 -175.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 94.3 Cg_endo -77.19 -177.63 3.97 Favored 'Trans proline' 0 CA--C 1.53 0.29 0 C-N-CA 123.032 2.488 . . . . 0.0 112.656 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.414 ' HD2' ' CB ' ' A' ' 2' ' ' ALA . 53.7 mtp180 -78.64 -9.37 59.36 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.798 -0.637 . . . . 0.0 110.846 -174.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 7.3 m -74.3 -9.0 58.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.519 -0.764 . . . . 0.0 110.596 177.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.548 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -84.55 144.22 28.8 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-N 115.935 -0.575 . . . . 0.0 110.638 179.092 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 13.4 m -80.8 167.67 19.67 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-N 116.042 -0.526 . . . . 0.0 110.749 178.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.91 -43.11 65.99 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 120.724 0.297 . . . . 0.0 111.679 -177.718 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -61.42 -35.86 78.73 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 116.227 -0.442 . . . . 0.0 111.166 178.588 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.548 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 41.1 t0 -70.22 -43.76 69.98 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.306 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.696 HG12 ' OH ' ' A' ' 4' ' ' TYR . 1.2 mp -61.12 -41.76 90.6 Favored 'Isoleucine or valine' 0 C--O 1.234 0.26 0 CA-C-N 116.438 -0.346 . . . . 0.0 110.743 175.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.842 ' HA ' ' CE2' ' A' ' 23' ' ' TYR . 58.0 mttm -55.6 -45.9 77.39 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.106 0.479 . . . . 0.0 111.001 173.587 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -35.01 79.33 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 116.04 -0.527 . . . . 0.0 110.502 178.879 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.676 ' O ' ' HG2' ' A' ' 25' ' ' ARG . . . -66.36 -43.9 84.68 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.894 -0.594 . . . . 0.0 112.04 -178.488 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.842 ' CE2' ' HA ' ' A' ' 20' ' ' LYS . 3.4 p90 -66.43 -37.15 84.55 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 119.497 -0.881 . . . . 0.0 109.966 178.671 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.428 HH11 ' HD2' ' A' ' 24' ' ' ARG . 26.5 mtp180 -57.2 -44.81 83.99 Favored 'General case' 0 C--O 1.225 -0.22 0 O-C-N 123.153 0.283 . . . . 0.0 111.164 177.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.676 ' HG2' ' O ' ' A' ' 22' ' ' ALA . 7.2 ptm180 -67.3 -34.43 77.37 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.103 0.478 . . . . 0.0 110.427 -177.702 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 32.7 ttmt -67.54 -38.42 84.16 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.121 175.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.529 ' HA ' ' CE2' ' A' ' 30' ' ' TRP . . . -55.49 -40.64 71.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.099 -0.501 . . . . 0.0 111.306 176.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.428 HD13 ' HA ' ' A' ' 28' ' ' LEU . 1.7 mm? -66.6 -35.9 81.3 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.154 -0.475 . . . . 0.0 111.055 175.468 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -62.39 -34.78 77.39 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 112.324 0.49 . . . . 0.0 112.324 -178.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.529 ' CE2' ' HA ' ' A' ' 27' ' ' ALA . 47.4 p-90 -105.14 12.27 32.22 Favored 'General case' 0 N--CA 1.466 0.353 0 CA-C-O 121.227 0.537 . . . . 0.0 110.745 178.296 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.611 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 16.4 t-80 -72.19 142.21 84.53 Favored Pre-proline 0 C--N 1.321 -0.662 0 N-CA-C 108.696 -0.853 . . . . 0.0 108.696 177.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.611 ' HD2' ' CG ' ' A' ' 31' ' ' HIS . 15.0 Cg_endo -54.44 -27.95 51.9 Favored 'Trans proline' 0 N--CA 1.482 0.797 0 C-N-CA 124.111 3.207 . . . . 0.0 114.616 -168.584 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -70.65 -29.84 66.29 Favored 'General case' 0 C--N 1.32 -0.675 0 C-N-CA 120.731 -0.388 . . . . 0.0 110.902 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 6.3 mptp? -91.69 -46.15 8.07 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.346 -0.388 . . . . 0.0 110.883 175.62 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.456 ' O ' ' HA ' ' A' ' 32' ' ' PRO . 67.2 t30 -103.42 129.12 26.05 Favored Pre-proline 0 C--N 1.327 -0.394 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 41.6 Cg_endo -91.1 -101.04 0.0 OUTLIER 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 122.577 2.185 . . . . 0.0 115.103 -167.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -86.32 -8.56 57.62 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.821 0.343 . . . . 0.0 111.84 -168.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 44.6 t-20 -94.85 99.9 11.88 Favored 'General case' 0 C--N 1.32 -0.707 0 C-N-CA 120.455 -0.498 . . . . 0.0 109.828 -179.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.501 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 0.9 OUTLIER -93.91 -18.38 22.01 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 116.112 -0.495 . . . . 0.0 109.964 178.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.567 ' O ' ' HB2' ' A' ' 44' ' ' LYS . 8.5 tp10 -54.95 -46.12 74.96 Favored 'General case' 0 C--O 1.231 0.13 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.121 179.988 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 18.9 m-85 -72.14 -40.77 67.83 Favored 'General case' 0 CA--C 1.516 -0.329 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.76 177.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.482 ' HA ' ' HB2' ' A' ' 30' ' ' TRP . . . -62.38 -45.97 90.73 Favored 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.871 -0.332 . . . . 0.0 111.225 -174.556 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.501 ' HG2' ' O ' ' A' ' 39' ' ' LYS . 12.0 pt-20 -71.71 -37.22 70.67 Favored 'General case' 0 C--N 1.331 -0.235 0 C-N-CA 120.82 -0.352 . . . . 0.0 110.995 177.635 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.567 ' HB2' ' O ' ' A' ' 40' ' ' GLU . 0.1 OUTLIER -65.96 -40.29 91.16 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.426 -0.352 . . . . 0.0 110.671 -177.938 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.486 ' O ' HG12 ' A' ' 49' ' ' VAL . 67.1 mmtt -69.28 -35.31 75.91 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 116.559 -0.291 . . . . 0.0 110.258 178.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 81.9 t80 -59.24 -42.65 91.57 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.994 -0.548 . . . . 0.0 109.949 173.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -66.77 -42.84 85.45 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.86 -0.609 . . . . 0.0 110.763 177.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 50.5 mt-10 -63.28 -44.45 95.05 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.108 -0.497 . . . . 0.0 111.244 -178.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.572 ' O ' ' HB3' ' A' ' 53' ' ' TYR . 8.3 p -72.59 -37.79 57.43 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 C-N-CA 120.891 -0.323 . . . . 0.0 111.304 -178.064 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.538 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -61.4 -45.94 92.24 Favored 'General case' 0 C--N 1.328 -0.339 0 C-N-CA 120.704 -0.398 . . . . 0.0 111.14 -176.636 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' O ' HG12 ' A' ' 55' ' ' VAL . 13.2 pt-20 -72.15 -43.23 64.97 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.021 0.439 . . . . 0.0 110.897 -179.41 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.802 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -72.5 -38.95 68.0 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.787 -0.642 . . . . 0.0 111.86 -173.435 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.572 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -70.99 -42.6 69.43 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 110.164 -0.31 . . . . 0.0 110.164 179.213 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.538 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 0.8 OUTLIER -58.64 -49.73 76.46 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.483 -177.48 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.649 ' HA ' ' HB3' ' A' ' 61' ' ' LYS . 9.3 p -70.06 -45.17 77.23 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.539 0 CA-C-N 116.343 -0.389 . . . . 0.0 112.003 -178.267 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.916 HD23 ' HD3' ' A' ' 62' ' ' ARG . 12.4 mt -74.87 -29.69 61.09 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 113.307 0.855 . . . . 0.0 113.307 -175.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 18.5 t -80.09 -18.36 50.17 Favored 'General case' 0 C--N 1.326 -0.418 0 C-N-CA 120.851 -0.339 . . . . 0.0 110.682 -177.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -111.91 127.45 55.85 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.209 0.528 . . . . 0.0 110.18 -177.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.646 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -69.19 -28.85 66.76 Favored 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.235 -173.466 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' HG12 ' A' ' 64' ' ' ILE . 49.6 m80 -68.63 -43.17 76.9 Favored 'General case' 0 C--N 1.321 -0.673 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.46 178.143 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.649 ' HB3' ' HA ' ' A' ' 55' ' ' VAL . 0.8 OUTLIER -70.25 -38.26 75.12 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-N 115.341 -0.845 . . . . 0.0 110.481 -178.922 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.916 ' HD3' HD23 ' A' ' 56' ' ' LEU . 12.2 mmm180 -58.15 -38.19 76.12 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.188 -0.46 . . . . 0.0 110.968 175.483 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.447 ' O ' ' HD2' ' A' ' 67' ' ' ARG . 6.1 mm-40 -66.19 -42.91 88.22 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.336 -0.393 . . . . 0.0 110.383 176.1 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 60' ' ' HIS . 41.5 mm -64.01 -44.29 97.79 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 CA-C-N 116.457 -0.338 . . . . 0.0 110.773 -177.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . 0.416 ' HB2' HG21 ' A' ' 55' ' ' VAL . 52.0 t80 -67.08 -37.37 83.85 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.405 -0.362 . . . . 0.0 110.881 -178.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -73.17 -46.3 51.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-O 121.024 0.44 . . . . 0.0 111.443 -178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 63' ' ' GLU . 4.1 ptm85 -81.28 -44.09 18.21 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.619 -173.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -94.89 -10.46 31.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.085 0.469 . . . . 0.0 110.396 -173.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -70.07 -49.56 33.41 Favored Glycine 0 CA--C 1.505 -0.57 0 C-N-CA 120.877 -0.678 . . . . 0.0 111.649 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -65.2 -25.37 67.68 Favored 'General case' 0 C--N 1.319 -0.741 0 CA-C-N 114.958 -0.621 . . . . 0.0 111.943 176.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.442 ' HG2' ' O ' ' A' ' 67' ' ' ARG . 28.1 mm-40 . . . . . 0 C--O 1.248 1.01 0 CA-C-O 118.691 -0.671 . . . . 0.0 111.042 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 21.8 mmt . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 69.72 -63.66 0.38 Allowed 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 123.675 0.79 . . . . 0.0 111.624 -177.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 39.8 m 65.83 -4.04 0.67 Allowed 'General case' 0 N--CA 1.468 0.453 0 C-N-CA 123.466 0.707 . . . . 0.0 112.632 177.773 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.575 ' O ' HG13 ' A' ' 7' ' ' ILE . 45.9 m-85 -68.37 -28.88 67.5 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 120.948 0.404 . . . . 0.0 111.114 -176.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 29.2 p90 -64.22 -32.46 74.06 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-O 121.006 0.432 . . . . 0.0 110.771 178.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -75.03 -43.84 51.32 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.313 176.186 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.575 HG13 ' O ' ' A' ' 4' ' ' TYR . 2.4 pp -70.36 -37.83 72.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.34 -174.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 45.3 tp -100.72 -84.62 0.43 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 116.24 -0.436 . . . . 0.0 110.8 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.818 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 31.8 t70 176.35 -33.24 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.426 ' HB ' ' HD2' ' A' ' 11' ' ' PRO . 27.3 m -119.99 156.77 54.16 Favored Pre-proline 0 C--N 1.324 -0.507 0 CA-C-N 114.994 -1.003 . . . . 0.0 110.145 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.426 ' HD2' ' HB ' ' A' ' 10' ' ' VAL . 86.6 Cg_endo -78.54 -177.49 3.93 Favored 'Trans proline' 0 CA--C 1.529 0.267 0 C-N-CA 122.92 2.413 . . . . 0.0 112.888 -178.603 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.7 ptt180 -77.53 -21.78 52.13 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.041 0.448 . . . . 0.0 111.126 -178.004 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.3 p -78.76 1.79 21.96 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.627 -0.715 . . . . 0.0 111.582 179.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.57 145.79 27.87 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-O 120.895 0.378 . . . . 0.0 110.737 177.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 48.1 t -70.51 160.84 31.7 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.79 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.43 -42.7 64.33 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.91 0.386 . . . . 0.0 111.667 -174.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -61.62 -35.66 78.5 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.921 -0.581 . . . . 0.0 111.545 -179.647 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -63.27 -45.77 89.91 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 110.422 177.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.4 HG12 ' CD2' ' A' ' 56' ' ' LEU . 2.0 mp -62.38 -45.63 98.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.339 -179.565 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -62.71 -39.91 95.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.773 0.32 . . . . 0.0 111.0 -178.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.776 ' HE2' ' HA ' ' A' ' 21' ' ' LYS . 0.0 OUTLIER -67.91 -42.15 81.58 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.651 -0.5 . . . . 0.0 109.651 177.289 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.818 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -60.78 -43.48 98.01 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 115.821 -0.627 . . . . 0.0 110.958 177.999 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.616 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.0 OUTLIER -62.16 -47.87 82.59 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.777 178.704 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.555 ' HG3' ' CE2' ' A' ' 23' ' ' TYR . 88.8 mtt180 -69.29 -39.32 78.4 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 112.464 0.542 . . . . 0.0 112.464 -178.194 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.434 ' HG2' ' HA ' ' A' ' 22' ' ' ALA . 5.0 ptp180 -63.0 -38.17 90.14 Favored 'General case' 0 C--N 1.326 -0.436 0 C-N-CA 120.065 -0.654 . . . . 0.0 110.632 178.095 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.484 ' HG3' ' HZ3' ' A' ' 30' ' ' TRP . 65.6 tttm -69.41 -40.75 77.13 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 121.221 0.534 . . . . 0.0 110.042 177.218 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -63.33 -44.57 94.54 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.56 -0.745 . . . . 0.0 111.597 177.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.48 ' HA ' ' HB2' ' A' ' 31' ' ' HIS . 7.4 mp -71.56 -37.2 71.11 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -176.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 50.8 mt-30 -67.84 -28.59 67.69 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 111.695 0.257 . . . . 0.0 111.695 -178.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.608 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 12.5 m-90 -109.01 18.62 20.46 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-O 121.551 0.691 . . . . 0.0 110.698 174.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.498 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 54.6 t60 -74.06 142.87 79.84 Favored Pre-proline 0 C--N 1.32 -0.683 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 172.639 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.765 ' HA ' ' OD1' ' A' ' 35' ' ' ASN . 11.3 Cg_endo -54.29 -28.92 55.07 Favored 'Trans proline' 0 C--N 1.352 0.762 0 C-N-CA 123.504 2.802 . . . . 0.0 113.343 -173.679 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -69.45 -23.76 63.71 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.251 177.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? -122.51 18.23 10.47 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.765 ' OD1' ' HA ' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -102.27 145.83 31.22 Favored Pre-proline 0 C--O 1.237 0.42 0 C-N-CA 119.677 -0.809 . . . . 0.0 111.536 -175.701 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -81.79 -110.78 0.01 OUTLIER 'Trans proline' 0 CA--C 1.534 0.511 0 C-N-CA 122.997 2.464 . . . . 0.0 113.421 -178.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -93.48 -11.68 31.46 Favored 'General case' 0 C--N 1.331 -0.228 0 CA-C-O 120.774 0.321 . . . . 0.0 111.524 -174.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.469 ' HB2' ' HB2' ' A' ' 41' ' ' PHE . 7.3 p30 -106.92 114.71 28.96 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 120.95 0.405 . . . . 0.0 111.036 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.556 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 5.5 mptt -103.86 -32.3 9.36 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 175.044 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.59 ' O ' ' HE2' ' A' ' 44' ' ' LYS . 0.6 OUTLIER -66.93 -43.99 81.81 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.236 -0.893 . . . . 0.0 110.496 177.96 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.469 ' HB2' ' HB2' ' A' ' 38' ' ' ASN . 75.0 m-85 -72.33 -37.39 68.9 Favored 'General case' 0 C--N 1.321 -0.633 0 CA-C-N 116.021 -0.536 . . . . 0.0 111.095 177.647 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.608 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -61.46 -45.41 94.39 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.315 -0.402 . . . . 0.0 110.795 178.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.437 ' HG3' ' N ' ' A' ' 44' ' ' LYS . 0.3 OUTLIER -67.65 -35.77 79.51 Favored 'General case' 0 C--N 1.326 -0.424 0 C-N-CA 120.783 -0.367 . . . . 0.0 110.146 176.742 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.603 ' O ' ' HG3' ' A' ' 48' ' ' GLU . 0.2 OUTLIER -61.93 -40.87 97.0 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 116.502 -0.317 . . . . 0.0 110.467 177.709 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 68.8 mmtt -63.87 -34.6 78.31 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-O 121.193 0.52 . . . . 0.0 109.666 177.123 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 85.6 t80 -66.77 -41.8 87.15 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.042 175.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -57.68 -44.9 86.12 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.662 176.443 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.603 ' HG3' ' O ' ' A' ' 44' ' ' LYS . 50.8 mt-10 -63.01 -45.6 91.59 Favored 'General case' 0 CA--C 1.515 -0.376 0 CA-C-O 121.054 0.454 . . . . 0.0 110.277 -177.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.616 HG22 ' HD1' ' A' ' 23' ' ' TYR . 9.7 p -70.88 -37.18 67.29 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.64 0 CA-C-N 116.02 -0.536 . . . . 0.0 111.126 -172.599 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.416 ' O ' ' HB2' ' A' ' 54' ' ' GLU . . . -63.9 -45.56 88.78 Favored 'General case' 0 C--N 1.328 -0.362 0 C-N-CA 120.842 -0.343 . . . . 0.0 111.041 179.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -72.66 -41.81 65.03 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.066 0.46 . . . . 0.0 110.747 -179.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.548 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -73.14 -43.66 61.25 Favored 'General case' 0 N--CA 1.451 -0.402 0 CA-C-N 115.899 -0.591 . . . . 0.0 111.996 -174.341 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.477 ' HB3' ' O ' ' A' ' 49' ' ' VAL . 0.0 OUTLIER -66.97 -35.38 79.84 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 109.411 -0.589 . . . . 0.0 109.411 178.837 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.416 ' HB2' ' O ' ' A' ' 50' ' ' ALA . 13.5 tp10 -60.73 -50.78 72.09 Favored 'General case' 0 C--N 1.331 -0.205 0 CA-C-N 116.185 -0.461 . . . . 0.0 110.607 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.818 ' HA ' ' HD2' ' A' ' 61' ' ' LYS . 10.0 p -71.35 -39.55 72.12 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 CA-C-N 116.368 -0.378 . . . . 0.0 111.582 -179.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.436 HD23 ' O ' ' A' ' 56' ' ' LEU . 9.4 tt -72.83 -28.9 62.83 Favored 'General case' 0 N--CA 1.465 0.284 0 N-CA-C 112.089 0.403 . . . . 0.0 112.089 -173.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 54.6 m -78.0 -15.33 59.04 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 120.816 -0.354 . . . . 0.0 111.409 -175.139 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.531 ' O ' ' HG2' ' A' ' 62' ' ' ARG . 30.5 t70 -112.15 121.46 45.0 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 109.707 -0.479 . . . . 0.0 109.707 177.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.502 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 1.0 OUTLIER -61.67 -34.33 75.54 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 115.454 -0.794 . . . . 0.0 110.549 -175.351 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.3 m80 -69.76 -44.5 70.04 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.868 -0.606 . . . . 0.0 110.776 -177.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.818 ' HD2' ' HA ' ' A' ' 55' ' ' VAL . 22.8 ttmm -71.01 -43.37 68.1 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.756 -0.656 . . . . 0.0 110.915 -174.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.531 ' HG2' ' O ' ' A' ' 58' ' ' ASP . 27.1 ptt180 -67.57 -38.57 84.3 Favored 'General case' 0 C--N 1.326 -0.43 0 C-N-CA 120.826 -0.35 . . . . 0.0 111.511 -177.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 59' ' ' LYS . 8.9 pt-20 -72.68 -36.39 67.88 Favored 'General case' 0 C--N 1.332 -0.174 0 C-N-CA 120.189 -0.604 . . . . 0.0 110.498 177.6 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 1.4 mp -64.91 -39.36 85.41 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.236 0 N-CA-C 110.126 -0.324 . . . . 0.0 110.126 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.61 -35.32 80.63 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-O 121.007 0.432 . . . . 0.0 110.33 175.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -72.8 -48.9 34.16 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.802 -0.635 . . . . 0.0 111.896 -177.02 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -90.23 -42.13 11.18 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 112.872 0.693 . . . . 0.0 112.872 -177.386 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -95.04 -10.67 30.14 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-O 120.873 0.368 . . . . 0.0 110.359 -170.382 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.14 -46.58 93.69 Favored Glycine 0 CA--C 1.505 -0.54 0 C-N-CA 120.9 -0.666 . . . . 0.0 111.695 177.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 30.3 mmm180 -61.9 -26.67 68.31 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 114.451 -0.874 . . . . 0.0 111.903 177.494 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 . . . . . 0 C--O 1.249 1.074 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.419 -177.566 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.478 0.97 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -131.75 144.2 50.79 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 116.228 -0.442 . . . . 0.0 110.331 -178.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 27.0 m -63.53 -8.19 8.93 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.062 -0.517 . . . . 0.0 111.983 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.736 ' HA ' HG12 ' A' ' 7' ' ' ILE . 34.1 m-85 -63.09 -28.06 69.82 Favored 'General case' 0 C--O 1.232 0.165 0 CA-C-O 121.296 0.57 . . . . 0.0 109.823 174.488 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.9 t80 -61.26 -37.62 83.77 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.205 177.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.9 mm-40 -74.0 -42.6 60.13 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.689 -0.687 . . . . 0.0 112.132 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.853 HD12 ' HB1' ' A' ' 52' ' ' ALA . 11.2 pt -70.98 -41.99 76.98 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 116.495 -0.32 . . . . 0.0 111.697 -172.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.55 ' HA ' ' HD2' ' A' ' 26' ' ' LYS . 15.6 mt -102.83 -74.82 0.62 Allowed 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.015 0.436 . . . . 0.0 110.312 178.004 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 22.4 t70 172.07 -31.25 0.0 OUTLIER 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 114.256 -1.338 . . . . 0.0 109.804 -173.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.407 ' HA ' ' HD3' ' A' ' 11' ' ' PRO . 25.1 m -120.98 150.62 53.59 Favored Pre-proline 0 C--N 1.323 -0.552 0 CA-C-N 115.439 -0.8 . . . . 0.0 109.831 179.699 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 10' ' ' VAL . 7.6 Cg_endo -87.5 -172.2 0.83 Allowed 'Trans proline' 0 N--CA 1.453 -0.899 0 C-N-CA 123.247 2.632 . . . . 0.0 112.968 -176.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.497 ' HB3' ' CD2' ' A' ' 4' ' ' TYR . 15.7 ptm180 -68.31 -21.29 64.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.892 -0.594 . . . . 0.0 111.717 -178.122 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.3 p -67.94 -15.96 63.85 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-N 115.63 -0.714 . . . . 0.0 110.979 179.551 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -84.05 144.21 29.23 Favored 'General case' 0 N--CA 1.443 -0.79 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.084 176.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 5.7 p -72.97 148.17 44.51 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.354 -0.384 . . . . 0.0 110.136 177.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -53.2 -31.08 41.14 Favored 'General case' 0 N--CA 1.468 0.429 0 N-CA-C 113.351 0.871 . . . . 0.0 113.351 -167.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . 0.549 ' O ' ' HG2' ' A' ' 20' ' ' LYS . 2.9 m-20 -65.71 -35.27 80.28 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 120.768 0.318 . . . . 0.0 111.37 179.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -67.39 -37.33 82.96 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.487 0.66 . . . . 0.0 109.433 176.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.428 HG23 HD13 ' A' ' 8' ' ' LEU . 1.7 mp -60.31 -46.78 94.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 115.137 -0.938 . . . . 0.0 111.2 175.637 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.549 ' HG2' ' O ' ' A' ' 17' ' ' ASP . 21.1 pttm -66.01 -33.86 76.77 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.004 0.431 . . . . 0.0 110.359 -179.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.443 ' HA ' ' HD2' ' A' ' 21' ' ' LYS . 7.8 tptm -66.71 -41.63 87.66 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-N 116.217 -0.447 . . . . 0.0 110.377 176.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.596 ' O ' ' HG3' ' A' ' 26' ' ' LYS . . . -61.68 -40.16 93.98 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.476 177.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -57.42 -42.18 81.83 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.885 -0.598 . . . . 0.0 110.762 175.848 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 78.7 mtp180 -64.92 -38.18 90.11 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.991 0.424 . . . . 0.0 110.899 178.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 30.9 ttt180 -67.3 -44.38 79.36 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.098 -0.501 . . . . 0.0 111.389 -179.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.596 ' HG3' ' O ' ' A' ' 22' ' ' ALA . 26.1 mtpp -62.83 -38.86 92.43 Favored 'General case' 0 CA--C 1.517 -0.322 0 CA-C-O 121.065 0.459 . . . . 0.0 109.804 176.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.17 -46.16 75.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.166 -0.925 . . . . 0.0 110.881 177.735 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 8.2 mp -70.6 -36.93 73.78 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.038 178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 57.1 tt0 -62.07 -39.82 93.7 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.664 -0.698 . . . . 0.0 111.535 -176.274 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.533 ' O ' ' HB1' ' A' ' 42' ' ' ALA . 96.6 m95 -109.02 18.03 21.07 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.87 0.367 . . . . 0.0 111.87 -176.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -77.61 145.66 71.72 Favored Pre-proline 0 C--N 1.324 -0.527 0 N-CA-C 109.112 -0.699 . . . . 0.0 109.112 170.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.572 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 14.8 Cg_endo -55.27 -28.42 62.13 Favored 'Trans proline' 0 C--N 1.348 0.51 0 C-N-CA 124.02 3.147 . . . . 0.0 113.695 -170.381 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -65.48 -29.26 69.9 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.958 0.408 . . . . 0.0 111.023 178.02 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 3.8 mptp? -108.44 14.83 24.42 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 121.087 0.47 . . . . 0.0 110.329 179.162 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.572 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 28.6 t-20 -115.33 134.46 22.58 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.022 -0.535 . . . . 0.0 110.653 -176.332 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo -89.04 -107.81 0.0 OUTLIER 'Trans proline' 0 N--CA 1.453 -0.884 0 C-N-CA 122.838 2.359 . . . . 0.0 113.61 -179.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -98.73 -10.22 23.45 Favored 'General case' 0 N--CA 1.463 0.194 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -170.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.485 ' HB3' ' HD1' ' A' ' 41' ' ' PHE . 10.0 m120 -106.39 100.6 10.12 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.473 -0.491 . . . . 0.0 111.058 178.101 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.9 mptm? -91.44 -28.66 17.51 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.315 -0.402 . . . . 0.0 109.993 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -56.4 -43.94 79.82 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.555 -0.748 . . . . 0.0 110.565 178.27 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.485 ' HD1' ' HB3' ' A' ' 38' ' ' ASN . 83.8 m-85 -66.99 -37.86 84.99 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.691 179.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.533 ' HB1' ' O ' ' A' ' 30' ' ' TRP . . . -66.46 -44.95 81.32 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-N 116.48 -0.327 . . . . 0.0 111.347 -179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -69.36 -37.96 77.85 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.594 179.288 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.737 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 9.2 mtpm? -65.28 -46.1 81.81 Favored 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 120.944 -0.303 . . . . 0.0 110.719 176.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 65.4 mmtt -64.61 -34.51 78.44 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 0.0 110.472 -178.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 65.8 t80 -62.74 -40.86 98.52 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 115.765 -0.652 . . . . 0.0 109.661 174.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.419 ' HE3' ' OE2' ' A' ' 48' ' ' GLU . 0.0 OUTLIER -70.1 -33.94 72.49 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.435 176.202 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.737 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 17.3 mm-40 -63.8 -45.54 89.2 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 120.926 0.393 . . . . 0.0 110.616 179.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 6.5 p -71.08 -36.13 61.78 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.399 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.181 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.67 -46.57 81.05 Favored 'General case' 0 C--N 1.325 -0.472 0 C-N-CA 120.77 -0.372 . . . . 0.0 111.181 179.996 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.416 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 11.5 pt-20 -73.3 -43.54 60.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.109 0.481 . . . . 0.0 110.807 179.561 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.853 ' HB1' HD12 ' A' ' 7' ' ' ILE . . . -70.3 -38.92 75.07 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.718 -173.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 26.5 t80 -72.37 -37.82 68.68 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.308 178.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -61.16 -50.35 73.54 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.578 -0.449 . . . . 0.0 111.18 178.179 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 11.9 p -65.81 -42.74 92.91 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.374 -0.376 . . . . 0.0 111.376 -175.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 40.0 tp -74.35 -29.24 61.49 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -177.874 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 25.6 t -79.74 -14.73 58.52 Favored 'General case' 0 C--N 1.33 -0.273 0 C-N-CA 120.945 -0.302 . . . . 0.0 110.82 -177.701 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.671 ' HB3' ' HD3' ' A' ' 61' ' ' LYS . 38.5 m-20 -109.68 121.37 45.06 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 109.476 -0.564 . . . . 0.0 109.476 177.604 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.411 ' HD3' ' N ' ' A' ' 60' ' ' HIS . 0.1 OUTLIER -66.03 -34.98 79.32 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.62 -0.718 . . . . 0.0 110.825 -173.154 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HA ' ' OE2' ' A' ' 63' ' ' GLU . 64.8 t60 -71.93 -38.13 69.9 Favored 'General case' 0 C--N 1.328 -0.33 0 C-N-CA 120.983 -0.287 . . . . 0.0 111.337 177.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.671 ' HD3' ' HB3' ' A' ' 58' ' ' ASP . 1.8 mptm? -68.69 -45.06 72.65 Favored 'General case' 0 C--N 1.325 -0.49 0 C-N-CA 120.847 -0.341 . . . . 0.0 110.777 -178.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.437 ' HE ' ' HB2' ' A' ' 62' ' ' ARG . 0.3 OUTLIER -68.03 -33.91 75.49 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 120.877 -0.329 . . . . 0.0 111.457 -178.119 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.555 ' OE2' ' HA ' ' A' ' 60' ' ' HIS . 15.8 pt-20 -69.65 -37.0 76.59 Favored 'General case' 0 C--O 1.233 0.216 0 C-N-CA 120.552 -0.459 . . . . 0.0 109.835 177.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.0 mm -66.31 -44.09 91.2 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.234 0 CA-C-N 116.015 -0.538 . . . . 0.0 110.062 175.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -62.61 -34.43 76.99 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.98 -0.554 . . . . 0.0 110.804 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -68.19 -47.13 68.77 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 116.22 -0.446 . . . . 0.0 111.6 -179.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -89.4 -34.37 16.52 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -105.08 -4.1 22.32 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.221 0.534 . . . . 0.0 110.909 -174.281 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -61.93 -50.64 63.69 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 121.052 -0.594 . . . . 0.0 112.315 178.676 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 -59.97 -37.57 79.98 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.005 -0.598 . . . . 0.0 111.848 178.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 . . . . . 0 C--O 1.245 0.837 0 CA-C-O 118.627 -0.702 . . . . 0.0 111.088 -176.349 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 pmm? . . . . . 0 N--CA 1.48 1.026 0 N-CA-C 110.026 -0.361 . . . . 0.0 110.026 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -138.52 109.32 6.68 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 120.652 0.263 . . . . 0.0 110.676 176.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 43.3 m -64.24 -16.39 61.94 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.17 0.509 . . . . 0.0 110.698 177.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.681 ' HA ' HG13 ' A' ' 7' ' ' ILE . 60.9 m-85 -66.42 -27.97 68.25 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.468 178.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . . . . . . . . . 71.0 t80 -63.99 -37.17 86.43 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.391 0.615 . . . . 0.0 109.553 175.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -73.14 -44.17 60.52 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.145 -0.934 . . . . 0.0 111.207 178.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.848 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.7 pp -71.75 -37.8 63.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 -176.446 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.433 ' N ' HD12 ' A' ' 7' ' ' ILE . 34.9 tp -99.89 -87.81 0.36 Allowed 'General case' 0 C--N 1.327 -0.379 0 C-N-CA 120.866 -0.334 . . . . 0.0 110.504 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.414 ' HB3' ' O ' ' A' ' 8' ' ' LEU . 5.7 p-10 170.65 -11.28 0.0 OUTLIER 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.212 0.605 . . . . 0.0 110.376 177.786 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.479 HG21 ' HA ' ' A' ' 19' ' ' ILE . 19.8 m -119.95 151.67 52.95 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.502 174.973 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_endo -90.31 -168.18 0.28 Allowed 'Trans proline' 0 N--CA 1.461 -0.419 0 C-N-CA 123.217 2.611 . . . . 0.0 113.639 -175.853 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.6 ptp180 -78.53 -31.48 47.57 Favored 'General case' 0 N--CA 1.462 0.174 0 N-CA-C 112.108 0.41 . . . . 0.0 112.108 -174.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 67.8 m -70.58 -7.29 42.91 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.995 0.426 . . . . 0.0 111.29 -177.471 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -76.3 144.06 40.47 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 116.072 -0.513 . . . . 0.0 110.036 176.198 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.7 t -74.94 154.93 37.93 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 116.419 -0.355 . . . . 0.0 110.229 179.303 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.24 -41.12 62.5 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.92 0.391 . . . . 0.0 111.434 -174.785 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 3.5 p-10 -63.42 -34.41 77.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.578 178.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 14.1 t70 -68.85 -41.13 78.86 Favored 'General case' 0 C--N 1.323 -0.55 0 N-CA-C 110.188 -0.301 . . . . 0.0 110.188 177.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.479 ' HA ' HG21 ' A' ' 10' ' ' VAL . 2.0 mp -60.66 -41.88 89.8 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.26 0 CA-C-O 121.314 0.578 . . . . 0.0 109.692 172.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.413 ' NZ ' ' HB2' ' A' ' 20' ' ' LYS . 0.1 OUTLIER -59.15 -42.66 91.24 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.217 -0.902 . . . . 0.0 110.011 177.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -66.49 -42.77 86.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.607 179.255 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -60.33 -41.47 93.65 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.297 -0.411 . . . . 0.0 110.567 179.08 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . 0.67 ' HD1' HG22 ' A' ' 49' ' ' VAL . 0.6 OUTLIER -64.22 -42.02 96.75 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.947 -0.569 . . . . 0.0 110.921 175.085 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 97.6 mtt180 -65.03 -43.53 92.09 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 111.658 0.244 . . . . 0.0 111.658 -177.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.497 ' O ' ' HG2' ' A' ' 29' ' ' GLN . 25.3 ptt180 -69.86 -39.21 76.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.868 0.366 . . . . 0.0 110.486 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -64.54 -39.82 94.45 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.591 176.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -65.24 -39.26 92.47 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.463 -0.79 . . . . 0.0 111.122 176.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -60.48 -40.29 90.73 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.066 179.334 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.497 ' HG2' ' O ' ' A' ' 25' ' ' ARG . 26.9 mm-40 -62.85 -37.32 86.37 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.215 -0.448 . . . . 0.0 111.261 -178.273 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . 0.43 ' CE3' ' HB3' ' A' ' 45' ' ' LYS . 13.2 m0 -110.18 19.42 18.94 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.086 0.47 . . . . 0.0 111.269 -176.739 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -72.71 141.2 82.07 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 179.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 11.5 Cg_endo -55.58 -29.11 68.47 Favored 'Trans proline' 0 C--N 1.344 0.335 0 C-N-CA 123.382 2.722 . . . . 0.0 112.362 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -65.22 -33.31 75.69 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.77 176.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 47.8 mmtm -115.83 18.9 15.47 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.79 -0.641 . . . . 0.0 110.734 -173.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.46 ' OD1' ' HD2' ' A' ' 39' ' ' LYS . 26.8 t-20 -115.51 135.16 22.57 Favored Pre-proline 0 C--N 1.323 -0.546 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.851 -178.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 35' ' ' ASN . 58.8 Cg_endo -88.12 -106.96 0.0 OUTLIER 'Trans proline' 0 CA--C 1.538 0.699 0 C-N-CA 122.924 2.416 . . . . 0.0 114.05 -177.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -97.06 -8.41 30.41 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 112.96 0.726 . . . . 0.0 112.96 -171.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.2 m120 -103.25 99.41 9.27 Favored 'General case' 0 C--N 1.32 -0.706 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 -179.857 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.46 ' HD2' ' OD1' ' A' ' 35' ' ' ASN . 12.4 mmmm -101.99 -30.0 11.46 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 120.966 -0.294 . . . . 0.0 111.227 -171.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -61.33 -45.53 94.06 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.94 -0.573 . . . . 0.0 111.002 -174.273 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 2.4 p90 -72.04 -36.4 69.62 Favored 'General case' 0 C--N 1.321 -0.65 0 C-N-CA 120.348 -0.541 . . . . 0.0 110.168 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.58 -44.3 96.66 Favored 'General case' 0 C--N 1.332 -0.167 0 CA-C-O 120.727 0.298 . . . . 0.0 111.007 -178.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -69.55 -42.3 74.77 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 116.573 -0.285 . . . . 0.0 111.081 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.8 mtpt -70.16 -37.71 75.29 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-N 116.701 -0.227 . . . . 0.0 111.324 -178.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.497 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 64.4 mmtt -68.26 -35.18 77.51 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.882 -0.327 . . . . 0.0 110.657 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -62.84 -39.71 95.2 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.28 0.562 . . . . 0.0 109.694 174.666 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -65.53 -44.01 88.24 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.736 -0.665 . . . . 0.0 110.388 177.678 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 33.8 mt-10 -66.34 -42.62 87.86 Favored 'General case' 0 C--O 1.225 -0.213 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.77 -178.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.67 HG22 ' HD1' ' A' ' 23' ' ' TYR . 7.0 p -66.11 -37.29 79.43 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 C-N-CA 120.426 -0.51 . . . . 0.0 110.876 178.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.528 ' HA ' ' HD2' ' A' ' 53' ' ' TYR . . . -62.19 -45.44 93.37 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-O 120.892 0.377 . . . . 0.0 111.599 -178.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -71.56 -37.65 71.05 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.071 0.462 . . . . 0.0 110.41 179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.848 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -75.4 -39.29 59.23 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.535 -0.757 . . . . 0.0 112.085 -174.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.528 ' HD2' ' HA ' ' A' ' 50' ' ' ALA . 0.3 OUTLIER -72.12 -35.34 69.11 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 179.01 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 22.5 tt0 -61.63 -48.11 82.34 Favored 'General case' 0 C--N 1.332 -0.169 0 CA-C-N 116.281 -0.418 . . . . 0.0 110.577 179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.63 ' O ' ' HG3' ' A' ' 62' ' ' ARG . 14.3 p -65.63 -38.8 83.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.372 -0.376 . . . . 0.0 110.955 -178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.441 HD22 ' HB3' ' A' ' 4' ' ' TYR . 52.5 tp -72.67 -28.19 62.56 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 111.675 0.25 . . . . 0.0 111.675 -179.929 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 19.1 t -78.57 -20.09 51.34 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.989 0.423 . . . . 0.0 110.328 -176.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.751 ' HB2' ' HB2' ' A' ' 61' ' ' LYS . 73.1 m-20 -111.77 121.85 46.2 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.339 -0.391 . . . . 0.0 110.595 179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.573 ' HD3' ' H ' ' A' ' 59' ' ' LYS . 3.4 mppt? -67.2 -34.29 77.19 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.106 -0.701 . . . . 0.0 109.106 176.335 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' HG12 ' A' ' 64' ' ' ILE . 81.9 m-70 -69.73 -32.86 71.65 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 114.856 -1.066 . . . . 0.0 111.076 176.814 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.751 ' HB2' ' HB2' ' A' ' 58' ' ' ASP . 1.2 tppp? -71.41 -41.68 69.28 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 109.543 -0.54 . . . . 0.0 109.543 178.555 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.63 ' HG3' ' O ' ' A' ' 55' ' ' VAL . 25.7 mtp180 -61.98 -42.6 99.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.576 177.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.473 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 13.1 pt-20 -67.55 -33.12 74.39 Favored 'General case' 0 C--N 1.329 -0.294 0 C-N-CA 120.412 -0.515 . . . . 0.0 110.202 -179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.495 HG12 ' O ' ' A' ' 60' ' ' HIS . 24.6 mm -65.2 -44.11 95.33 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.215 0 N-CA-C 109.908 -0.404 . . . . 0.0 109.908 175.012 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 38.1 t80 -59.15 -37.48 77.41 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 121.259 0.552 . . . . 0.0 109.876 175.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 21.4 t70 -72.27 -47.25 51.59 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.392 -0.822 . . . . 0.0 112.144 -176.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -88.49 -37.51 15.72 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.749 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.504 ' HA ' ' HG2' ' A' ' 71' ' ' GLU . 32.3 t80 -95.44 -9.49 32.52 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.877 0.37 . . . . 0.0 110.543 -173.825 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -62.69 -48.01 84.69 Favored Glycine 0 CA--C 1.51 -0.271 0 C-N-CA 120.868 -0.682 . . . . 0.0 111.635 175.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 33.7 mmt180 -63.41 -25.98 68.53 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 114.473 -0.864 . . . . 0.0 111.465 178.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.504 ' HG2' ' HA ' ' A' ' 68' ' ' TYR . 18.4 mm-40 . . . . . 0 C--O 1.25 1.098 0 CA-C-O 118.675 -0.679 . . . . 0.0 111.07 -176.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 93.3 mmm . . . . . 0 N--CA 1.481 1.082 0 CA-C-O 120.358 0.123 . . . . 0.0 110.924 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.421 ' HB3' ' CE2' ' A' ' 5' ' ' TYR . . . -65.32 -45.88 82.53 Favored 'General case' 0 C--N 1.334 -0.097 0 CA-C-O 120.662 0.268 . . . . 0.0 111.327 -179.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 20.7 t 68.59 -14.09 0.29 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 113.131 0.789 . . . . 0.0 113.131 172.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' TYR . . . . . 0.575 ' CD1' ' HG ' ' A' ' 56' ' ' LEU . 0.0 OUTLIER -62.69 -38.08 88.97 Favored 'General case' 0 C--N 1.329 -0.313 0 O-C-N 122.002 -0.436 . . . . 0.0 111.32 -176.956 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' TYR . . . . . 0.421 ' CE2' ' HB3' ' A' ' 2' ' ' ALA . 3.6 p90 -61.3 -32.14 71.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 116.465 -0.334 . . . . 0.0 111.034 174.781 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -73.71 -45.09 54.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.916 0.388 . . . . 0.0 111.077 177.281 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.782 HD13 ' HB1' ' A' ' 52' ' ' ALA . 2.6 pp -71.72 -30.99 40.16 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.22 0 CA-C-N 116.07 -0.514 . . . . 0.0 111.813 -176.403 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 64.0 tp -99.66 -87.03 0.37 Allowed 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.903 -0.319 . . . . 0.0 111.424 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.75 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 23.9 t70 177.85 -33.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.163 0 CA-C-O 121.038 0.447 . . . . 0.0 110.853 -174.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 27.1 m -121.02 156.52 56.77 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.417 -174.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -92.99 174.48 1.8 Allowed 'Trans proline' 0 N--CA 1.458 -0.579 0 C-N-CA 123.487 2.791 . . . . 0.0 112.844 178.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.801 ' HD3' ' H ' ' A' ' 12' ' ' ARG . 0.0 OUTLIER -57.34 -22.67 43.9 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 114.711 -1.132 . . . . 0.0 113.842 -168.974 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 4.7 t -58.64 -24.12 60.5 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-O 120.925 0.393 . . . . 0.0 111.113 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.888 ' HB1' ' HB3' ' A' ' 18' ' ' ASP . . . -78.82 143.78 35.69 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.144 0.497 . . . . 0.0 111.719 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 41.7 t -78.54 164.66 24.51 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.431 -0.804 . . . . 0.0 109.658 173.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -52.14 -34.44 44.68 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 121.168 0.509 . . . . 0.0 111.451 -176.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -61.99 -42.67 99.4 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.813 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ASP . . . . . 0.888 ' HB3' ' HB1' ' A' ' 14' ' ' ALA . 11.3 t70 -69.34 -36.61 77.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.808 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 1.5 mp -59.12 -43.84 90.27 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.995 172.471 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.6 ttmm -65.13 -37.86 88.78 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.043 178.304 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.627 ' HA ' ' HE ' ' A' ' 24' ' ' ARG . 0.6 OUTLIER -70.24 -35.28 73.72 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 120.946 -0.302 . . . . 0.0 111.357 175.413 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.75 ' HB1' ' HB3' ' A' ' 9' ' ' ASP . . . -59.82 -42.09 92.75 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.26 0.552 . . . . 0.0 110.736 177.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -64.66 -40.85 96.13 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.65 -0.704 . . . . 0.0 110.408 173.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.627 ' HE ' ' HA ' ' A' ' 21' ' ' LYS . 9.9 mtm180 -67.19 -45.57 76.51 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.936 -0.574 . . . . 0.0 111.897 -178.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 29' ' ' GLN . 1.6 ptm180 -64.81 -32.63 74.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.865 0.364 . . . . 0.0 110.336 178.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.518 ' HA ' ' OE1' ' A' ' 29' ' ' GLN . 0.6 OUTLIER -71.31 -38.89 71.7 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 121.126 0.489 . . . . 0.0 110.139 176.979 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -55.19 -37.09 66.62 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.767 -0.651 . . . . 0.0 110.74 171.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.405 ' O ' ' HB2' ' A' ' 31' ' ' HIS . 8.1 mp -67.86 -35.72 79.04 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.864 -0.607 . . . . 0.0 111.423 175.397 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.518 ' OE1' ' HA ' ' A' ' 26' ' ' LYS . 50.9 mt-30 -62.24 -34.23 76.11 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 121.056 0.455 . . . . 0.0 110.295 177.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' TRP . . . . . . . . . . . . . 40.0 m95 -106.39 18.72 21.56 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.504 -178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.558 ' CG ' ' HD2' ' A' ' 32' ' ' PRO . 0.2 OUTLIER -71.42 152.05 94.07 Favored Pre-proline 0 C--N 1.324 -0.53 0 CA-C-N 115.861 -0.608 . . . . 0.0 109.445 -178.439 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.704 ' HA ' ' HB3' ' A' ' 35' ' ' ASN . 11.2 Cg_endo -54.92 -29.36 63.54 Favored 'Trans proline' 0 C--N 1.349 0.589 0 C-N-CA 123.231 2.62 . . . . 0.0 112.791 -178.157 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.734 ' HB2' ' HD2' ' A' ' 34' ' ' LYS . 1.3 m-20 -60.92 -34.78 75.22 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 115.867 -0.606 . . . . 0.0 110.338 176.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.734 ' HD2' ' HB2' ' A' ' 33' ' ' ASP . 0.1 OUTLIER -108.11 18.06 21.59 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.678 -0.692 . . . . 0.0 109.719 -178.256 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASN . . . . . 0.704 ' HB3' ' HA ' ' A' ' 32' ' ' PRO . 26.4 t-20 -116.18 136.27 22.98 Favored Pre-proline 0 C--N 1.326 -0.456 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.097 -177.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.433 ' HB2' ' H ' ' A' ' 37' ' ' ASP . 53.1 Cg_endo -85.73 -121.93 0.01 OUTLIER 'Trans proline' 0 CA--C 1.535 0.566 0 C-N-CA 122.947 2.432 . . . . 0.0 112.723 179.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.433 ' H ' ' HB2' ' A' ' 36' ' ' PRO . 43.7 m-20 -97.44 -9.17 27.77 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.894 0.378 . . . . 0.0 111.137 -177.098 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -105.34 101.95 11.46 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.56 ' O ' ' HG3' ' A' ' 43' ' ' GLU . 51.4 mttm -99.42 -21.04 16.16 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.226 -0.443 . . . . 0.0 111.158 -174.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -57.27 -42.89 82.45 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.07 -0.514 . . . . 0.0 110.975 -175.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 3.7 p90 -67.35 -35.6 79.72 Favored 'General case' 0 C--N 1.333 -0.111 0 N-CA-C 110.348 -0.241 . . . . 0.0 110.348 179.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -62.61 -39.28 93.29 Favored 'General case' 0 C--N 1.334 -0.09 0 CA-C-O 120.829 0.347 . . . . 0.0 110.309 177.326 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 39' ' ' LYS . 24.3 mt-10 -69.44 -42.24 75.22 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.108 0.48 . . . . 0.0 109.825 176.097 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.585 ' O ' ' HG2' ' A' ' 48' ' ' GLU . 46.8 tptt -57.67 -46.7 83.93 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.705 179.037 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' A' ' 45' ' ' LYS . 65.1 mmtt -66.0 -35.49 80.72 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.84 0.352 . . . . 0.0 110.786 178.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 80.6 t80 -66.29 -39.9 89.68 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.789 179.059 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.427 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 95.2 mttt -66.7 -44.21 82.31 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.222 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 44' ' ' LYS . 16.5 mm-40 -65.11 -41.5 94.87 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.267 -0.424 . . . . 0.0 111.249 -177.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 7.6 p -71.04 -37.3 66.93 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.372 0 C-N-CA 120.714 -0.394 . . . . 0.0 110.603 179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.35 -45.15 92.18 Favored 'General case' 0 C--N 1.331 -0.217 0 CA-C-N 116.618 -0.264 . . . . 0.0 111.607 -179.573 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.468 ' HG3' ' N ' ' A' ' 52' ' ' ALA . 9.6 pt-20 -71.36 -41.6 69.54 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 121.173 0.511 . . . . 0.0 110.372 -179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.782 ' HB1' HD13 ' A' ' 7' ' ' ILE . . . -68.65 -42.7 77.59 Favored 'General case' 0 N--CA 1.449 -0.518 0 CA-C-N 115.334 -0.848 . . . . 0.0 111.534 -174.642 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -71.44 -38.31 71.35 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 110.122 -0.325 . . . . 0.0 110.122 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 4.7 tp10 -69.89 -43.45 71.75 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.511 -175.339 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.605 HG22 ' HD2' ' A' ' 62' ' ' ARG . 11.8 p -68.27 -37.23 77.69 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.222 0 CA-C-N 116.461 -0.336 . . . . 0.0 110.588 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.635 HD13 ' O ' ' A' ' 56' ' ' LEU . 1.9 tm? -72.17 -26.0 61.9 Favored 'General case' 0 C--N 1.332 -0.182 0 CA-C-O 120.907 0.384 . . . . 0.0 110.327 179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 29.2 t -76.32 -19.85 57.84 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.076 -174.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.624 ' OD2' ' HG2' ' A' ' 61' ' ' LYS . 23.1 t70 -112.36 121.63 45.4 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.42 0.629 . . . . 0.0 109.916 175.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.908 ' H ' ' HD2' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -65.68 -37.22 85.88 Favored 'General case' 0 C--N 1.318 -0.764 0 CA-C-N 115.27 -0.877 . . . . 0.0 111.99 -174.441 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.495 ' O ' ' HG2' ' A' ' 63' ' ' GLU . 47.0 t60 -68.91 -39.54 79.64 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.287 -179.208 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.624 ' HG2' ' OD2' ' A' ' 58' ' ' ASP . 41.5 mmtm -60.96 -36.15 78.64 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.744 -0.382 . . . . 0.0 111.219 177.029 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ARG . . . . . 0.605 ' HD2' HG22 ' A' ' 55' ' ' VAL . 9.8 mmm180 -63.81 -46.39 85.34 Favored 'General case' 0 C--N 1.33 -0.277 0 N-CA-C 111.848 0.314 . . . . 0.0 111.848 -178.203 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLU . . . . . 0.495 ' HG2' ' O ' ' A' ' 60' ' ' HIS . 17.2 pt-20 -65.43 -38.85 91.12 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.718 -0.393 . . . . 0.0 109.983 -179.015 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.522 HD13 ' HD3' ' A' ' 67' ' ' ARG . 44.5 mm -67.8 -44.09 85.79 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.203 0 CA-C-N 115.988 -0.551 . . . . 0.0 110.551 179.046 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -60.93 -42.79 98.81 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.894 -0.594 . . . . 0.0 111.259 -176.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -73.29 -42.06 62.85 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.328 0.492 . . . . 0.0 112.328 -178.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.522 ' HD3' HD13 ' A' ' 64' ' ' ILE . 8.0 ptm180 -72.17 -30.9 65.44 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-O 120.745 0.307 . . . . 0.0 111.452 -176.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.431 ' HB3' ' O ' ' A' ' 64' ' ' ILE . 0.1 OUTLIER -103.96 -6.13 21.54 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.421 0.629 . . . . 0.0 110.943 -174.446 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . -64.47 -48.99 67.79 Favored Glycine 0 N--CA 1.451 -0.308 0 CA-C-N 115.472 -0.785 . . . . 0.0 113.619 -178.377 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 27.2 mmm180 -58.4 -46.23 86.82 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 -176.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.4 mp0 . . . . . 0 C--O 1.249 1.056 0 CA-C-O 118.394 -0.813 . . . . 0.0 110.513 -179.521 . . . . . . . . 0 0 . 1 stop_ save_